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

Systemtic Name: (phenylmethyl) 2-[(3-cyano-4-phenyl-phenyl)methylamino]-3-methyl-butanoate Openeye Name: benzyl 2-[(3-cyano-4-phenyl-phenyl)methylamino]-3-methyl-butanoate CAS Name: 2-[(3-cyano-4-phenylphenyl)methylamino]-3-methylbutanoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[(3-cyano-4-phenylphenyl)methylamino]-3-methylbutanoate Traditional Name: 2-[(3-cyano-4-phenyl-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=C3)C#N

Isomeric SMILES

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

InChI

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