(2,4,6-trimethylcyclohexyl) 6-azanyl-2-(4-chlorophenyl)-4-oxidanylidene-3a,7-dihydroindene-1-carboxylate

Systemtic Name: (2,4,6-trimethylcyclohexyl) 6-azanyl-2-(4-chlorophenyl)-4-oxidanylidene-3a,7-dihydroindene-1-carboxylate Openeye Name: (2,4,6-trimethylcyclohexyl) 6-amino-2-(4-chlorophenyl)-4-oxo-3a,7-dihydroindene-1-carboxylate CAS Name: 6-amino-2-(4-chlorophenyl)-4-oxo-3a,7-dihydroindene-1-carboxylic acid (2,4,6-trimethylcyclohexyl) ester IUPAC Name: (2,4,6-trimethylcyclohexyl) 6-amino-2-(4-chlorophenyl)-4-oxo-3a,7-dihydroindene-1-carboxylate Traditional Name: 6-amino-2-(4-chlorophenyl)-4-keto-3a,7-dihydroindene-1-carboxylic acid (2,4,6-trimethylcyclohexyl) ester Formula: C25H28ClNO3 MolecularWeight: 425.94772

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(C(C(C1)C)OC(=O)C2=C3CC(=CC(=O)C3C=C2C4=CC=C(C=C4)Cl)N)C

Isomeric SMILES

CC1CC(C(C(C1)C)OC(=O)C2=C3CC(=CC(=O)C3C=C2C4=CC=C(C=C4)Cl)N)C

InChI

InChI=1S/C25H28ClNO3/c1-13-8-14(2)24(15(3)9-13)30-25(29)23-19(16-4-6-17(26)7-5-16)12-20-21(23)10-18(27)11-22(20)28/h4-7,11-15,20,24H,8-10,27H2,1-3H3