4-(6,9-dimethyl-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinolin-4-yl)benzoate

Systemtic Name: 4-(6,9-dimethyl-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinolin-4-yl)benzoate Openeye Name: 4-(6,9-dimethyl-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinolin-4-yl)benzoate CAS Name: 4-(6,9-dimethyl-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinolin-4-yl)benzoate IUPAC Name: 4-(6,9-dimethyl-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinolin-4-yl)benzoate Traditional Name: 4-(6,9-dimethyl-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinolin-4-yl)benzoate Formula: C21H20NO2- MolecularWeight: 318.389

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C3C=CCC3C(NC2=C(C=C1)C)C4=CC=C(C=C4)C(=O)[O-]

Isomeric SMILES

CC1=C2C3C=CCC3C(NC2=C(C=C1)C)C4=CC=C(C=C4)C(=O)[O-]

InChI

InChI=1S/C21H21NO2/c1-12-6-7-13(2)19-18(12)16-4-3-5-17(16)20(22-19)14-8-10-15(11-9-14)21(23)24/h3-4,6-11,16-17,20,22H,5H2,1-2H3,(H,23,24)/p-1