(phenylmethyl) 2-[[4-(2-cyanophenyl)phenyl]methylamino]-3-methyl-butanoate

Systemtic Name: (phenylmethyl) 2-[[4-(2-cyanophenyl)phenyl]methylamino]-3-methyl-butanoate Openeye Name: benzyl 2-[[4-(2-cyanophenyl)phenyl]methylamino]-3-methyl-butanoate CAS Name: 2-[[4-(2-cyanophenyl)phenyl]methylamino]-3-methylbutanoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[[4-(2-cyanophenyl)phenyl]methylamino]-3-methylbutanoate Traditional Name: 2-[[4-(2-cyanophenyl)benzyl]amino]-3-methyl-butyric acid benzyl ester Formula: C26H26N2O2 MolecularWeight: 398.49684

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCC1=CC=CC=C1)NCC2=CC=C(C=C2)C3=CC=CC=C3C#N

Isomeric SMILES

CC(C)C(C(=O)OCC1=CC=CC=C1)NCC2=CC=C(C=C2)C3=CC=CC=C3C#N

InChI

InChI=1S/C26H26N2O2/c1-19(2)25(26(29)30-18-21-8-4-3-5-9-21)28-17-20-12-14-22(15-13-20)24-11-7-6-10-23(24)16-27/h3-15,19,25,28H,17-18H2,1-2H3