Browse Molecules

Molecule ID SMILES Charge States Microspecies
mol23501 CCC(C)c1ccc(C(C)CC(=O)O)cc1 2 2
mol23502 CC/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)O 2 2
mol23503 CC/C(=C\c1cccc([N+](=O)[O-])c1)C(=O)O 2 2
mol23504 CCC(C(=O)O)N(C(C)=O)c1ccccc1 2 2
mol23505 CC(=O)N(c1ccccc1C)C(C)C(=O)O 2 2
mol23506 CC(C)Oc1ccc(CC(C)C(=O)O)cc1 0 0
mol23507 Cc1cc(CCC(=O)O)cc(C)c1[N+](=O)[O-] 0 0
mol23508 CC(C)(CC(=O)O)c1cccc([N+](=O)[O-])c1 0 0
mol23509 CC(C)(CC(=O)O)c1ccc([N+](=O)[O-])cc1 0 0
mol23510 CCC/C(=C\c1ccc(Cl)cc1)C(=O)O 2 2
mol23511 CCC/C(=C\c1cccc(Cl)c1)C(=O)O 2 2
mol23512 COc1cc(/C=C/C(=O)O)cc(OC)c1O 3 3
mol23513 Cc1cc(NCC(=O)O)cc(C)c1[N+](=O)[O-] 0 0
mol23514 O=C(O)/C(=C/c1ccccc1)c1ccccc1 0 0
mol23515 O=C(O)/C(=C\c1ccccc1)c1ccccc1 0 0
mol23516 O=C(O)/C=C\Sc1cccc([N+](=O)[O-])c1 0 0
mol23517 O=C(O)/C=C/Sc1cccc([N+](=O)[O-])c1 0 0
mol23518 O=C(O)/C=C/Sc1ccc([N+](=O)[O-])cc1 0 0
mol23519 O=C(O)/C=C\Sc1ccc([N+](=O)[O-])cc1 0 0
mol23520 Cc1cc(OCC(=O)O)cc(C)c1[N+](=O)[O-] 0 0