(phenylmethyl) 1-[(3-cyano-4-phenyl-phenyl)methyl-pentanoyl-amino]cyclopentane-1-carboxylate

Systemtic Name: (phenylmethyl) 1-[(3-cyano-4-phenyl-phenyl)methyl-pentanoyl-amino]cyclopentane-1-carboxylate Openeye Name: benzyl 1-[(3-cyano-4-phenyl-phenyl)methyl-pentanoyl-amino]cyclopentanecarboxylate CAS Name: 1-[(3-cyano-4-phenylphenyl)methyl-(1-oxopentyl)amino]-1-cyclopentanecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 1-[(3-cyano-4-phenylphenyl)methyl-pentanoylamino]cyclopentane-1-carboxylate Traditional Name: 1-[(3-cyano-4-phenyl-benzyl)-valeryl-amino]cyclopentanecarboxylic acid benzyl ester Formula: C32H34N2O3 MolecularWeight: 494.62396

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)N(CC1=CC(=C(C=C1)C2=CC=CC=C2)C#N)C3(CCCC3)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

CCCCC(=O)N(CC1=CC(=C(C=C1)C2=CC=CC=C2)C#N)C3(CCCC3)C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C32H34N2O3/c1-2-3-16-30(35)34(23-26-17-18-29(28(21-26)22-33)27-14-8-5-9-15-27)32(19-10-11-20-32)31(36)37-24-25-12-6-4-7-13-25/h4-9,12-15,17-18,21H,2-3,10-11,16,19-20,23-24H2,1H3