methyl 3-(4-chlorophenyl)-4,4-dimethyl-1-oxidanyl-3,7a-dihydro-2H-cyclopenta[c]pyridine-1-carboxylate

Systemtic Name: methyl 3-(4-chlorophenyl)-4,4-dimethyl-1-oxidanyl-3,7a-dihydro-2H-cyclopenta[c]pyridine-1-carboxylate Openeye Name: methyl 3-(4-chlorophenyl)-1-hydroxy-4,4-dimethyl-3,7a-dihydro-2H-cyclopenta[c]pyridine-1-carboxylate CAS Name: 3-(4-chlorophenyl)-1-hydroxy-4,4-dimethyl-3,7a-dihydro-2H-cyclopenta[c]pyridine-1-carboxylic acid methyl ester IUPAC Name: methyl 3-(4-chlorophenyl)-1-hydroxy-4,4-dimethyl-3,7a-dihydro-2H-cyclopenta[c]pyridine-1-carboxylate Traditional Name: 3-(4-chlorophenyl)-1-hydroxy-4,4-dimethyl-3,7a-dihydro-2H-2-pyrindine-1-carboxylic acid methyl ester Formula: C18H20ClNO3 MolecularWeight: 333.8093

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(NC(C2C1=CC=C2)(C(=O)OC)O)C3=CC=C(C=C3)Cl)C

Isomeric SMILES

CC1(C(NC(C2C1=CC=C2)(C(=O)OC)O)C3=CC=C(C=C3)Cl)C

InChI

InChI=1S/C18H20ClNO3/c1-17(2)13-5-4-6-14(13)18(22,16(21)23-3)20-15(17)11-7-9-12(19)10-8-11/h4-10,14-15,20,22H,1-3H3