naphthalen-2-yl 2-[[3-[(4-chlorophenyl)amino]phenyl]methyl]-2-cyano-3-methyl-butanoate

Systemtic Name: naphthalen-2-yl 2-[[3-[(4-chlorophenyl)amino]phenyl]methyl]-2-cyano-3-methyl-butanoate Openeye Name: 2-naphthyl 2-[[3-(4-chloroanilino)phenyl]methyl]-2-cyano-3-methyl-butanoate CAS Name: 2-[[3-(4-chloroanilino)phenyl]methyl]-2-cyano-3-methylbutanoic acid 2-naphthalenyl ester IUPAC Name: naphthalen-2-yl 2-[[3-(4-chloroanilino)phenyl]methyl]-2-cyano-3-methylbutanoate Traditional Name: 2-[3-(4-chloroanilino)benzyl]-2-cyano-3-methyl-butyric acid 2-naphthyl ester Formula: C29H25ClN2O2 MolecularWeight: 468.974

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CC1=CC(=CC=C1)NC2=CC=C(C=C2)Cl)(C#N)C(=O)OC3=CC4=CC=CC=C4C=C3

Isomeric SMILES

CC(C)C(CC1=CC(=CC=C1)NC2=CC=C(C=C2)Cl)(C#N)C(=O)OC3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C29H25ClN2O2/c1-20(2)29(19-31,28(33)34-27-15-10-22-7-3-4-8-23(22)17-27)18-21-6-5-9-26(16-21)32-25-13-11-24(30)12-14-25/h3-17,20,32H,18H2,1-2H3