pyridin-3-yl 3,3-dimethyl-2-[(4-methylphenyl)carbonyl-(phenylmethyl)amino]butanoate

Systemtic Name: pyridin-3-yl 3,3-dimethyl-2-[(4-methylphenyl)carbonyl-(phenylmethyl)amino]butanoate Openeye Name: 3-pyridyl 2-[benzyl-(4-methylbenzoyl)amino]-3,3-dimethyl-butanoate CAS Name: 3,3-dimethyl-2-[[(4-methylphenyl)-oxomethyl]-(phenylmethyl)amino]butanoic acid 3-pyridinyl ester IUPAC Name: pyridin-3-yl 2-[benzyl-(4-methylbenzoyl)amino]-3,3-dimethylbutanoate Traditional Name: 2-[benzyl(p-toluoyl)amino]-3,3-dimethyl-butyric acid 3-pyridyl ester Formula: C26H28N2O3 MolecularWeight: 416.51212

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N(CC2=CC=CC=C2)C(C(=O)OC3=CN=CC=C3)C(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N(CC2=CC=CC=C2)C(C(=O)OC3=CN=CC=C3)C(C)(C)C

InChI

InChI=1S/C26H28N2O3/c1-19-12-14-21(15-13-19)24(29)28(18-20-9-6-5-7-10-20)23(26(2,3)4)25(30)31-22-11-8-16-27-17-22/h5-17,23H,18H2,1-4H3