Browse Molecules

Molecule ID SMILES Charge States Microspecies
mol27041 C[n+]1cccc(C(=O)Cc2cccc([N+](=O)[O-])c2)c1 0 0
mol27042 C[n+]1ccc(CC(=O)c2ccc([N+](=O)[O-])cc2)cc1 0 0
mol27043 C[n+]1ccc(CC(=O)c2cccc([N+](=O)[O-])c2)cc1 0 0
mol27044 Cc1ccc(C(=O)C[n+]2ccc([N+](=O)[O-])cc2)cc1 0 0
mol27045 C[P+](C)(CC(=O)c1ccccc1)c1ccccc1 0 0
mol27046 CCN(Cc1ccccc1)C1=CC(=O)CC(C)(C)C1 0 0
mol27047 CC1(C)CC(=O)C(NC(=O)c2ccccc2)=C(O)C1 2 2
mol27048 CC1(C)CC(=O)C(NC(=O)c2ccccc2)C(=O)C1 2 2
mol27049 O=C(c1ccccc1)c1ccc(Br)cc1 0 0
mol27050 O=C(c1ccccc1)c1cccc(Br)c1 0 0
mol27051 CC(=O)c1ccc(S(=O)(=O)c2ccccc2)cc1 0 0
mol27052 O=C(CS(=O)(=O)c1ccccc1)c1ccccc1 2 2
mol27053 CC(=O)c1cccc(S(=O)(=O)c2ccccc2)c1 0 0
mol27054 O=C(CC(=O)C(F)(F)F)c1ccc([N+](=O)[O-])cc1 2 2
mol27055 CC(C)(C)/N=C1/C=C(C2=C(O)CCCC2=O)CCC1 3 3
mol27056 CN1/C(=C/C(=O)c2ccccc2)C=Cc2ccccc21 2 3
mol27057 C[n+]1c(CC(=O)c2ccccc2)ccc2ccccc21 0 0
mol27058 CN1C=C/C(=C\C(=O)c2ccccc2)c2ccccc21 2 3
mol27059 C[n+]1ccc(CC(=O)c2ccccc2)c2ccccc21 0 0
mol27060 O=C(Cc1ccc(C(F)(F)F)cc1)c1ccncc1 0 0