(phenylmethyl) 2-[1-[3-[(4-cyanophenyl)carbonylamino]-2,2-dimethyl-hexanoyl]piperidin-4-yl]ethanoate

Systemtic Name: (phenylmethyl) 2-[1-[3-[(4-cyanophenyl)carbonylamino]-2,2-dimethyl-hexanoyl]piperidin-4-yl]ethanoate Openeye Name: benzyl 2-[1-[3-[(4-cyanobenzoyl)amino]-2,2-dimethyl-hexanoyl]-4-piperidyl]acetate CAS Name: 2-[1-[3-[[(4-cyanophenyl)-oxomethyl]amino]-2,2-dimethyl-1-oxohexyl]-4-piperidinyl]acetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[1-[3-[(4-cyanobenzoyl)amino]-2,2-dimethylhexanoyl]piperidin-4-yl]acetate Traditional Name: 2-[1-[3-[(4-cyanobenzoyl)amino]-2,2-dimethyl-hexanoyl]-4-piperidyl]acetic acid benzyl ester Formula: C30H37N3O4 MolecularWeight: 503.63248

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(C)(C)C(=O)N1CCC(CC1)CC(=O)OCC2=CC=CC=C2)NC(=O)C3=CC=C(C=C3)C#N

Isomeric SMILES

CCCC(C(C)(C)C(=O)N1CCC(CC1)CC(=O)OCC2=CC=CC=C2)NC(=O)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C30H37N3O4/c1-4-8-26(32-28(35)25-13-11-23(20-31)12-14-25)30(2,3)29(36)33-17-15-22(16-18-33)19-27(34)37-21-24-9-6-5-7-10-24/h5-7,9-14,22,26H,4,8,15-19,21H2,1-3H3,(H,32,35)