methyl 2-[[4-(2-cyanophenyl)phenyl]methyl-pentanoyl-amino]ethanoate

Systemtic Name: methyl 2-[[4-(2-cyanophenyl)phenyl]methyl-pentanoyl-amino]ethanoate Openeye Name: methyl 2-[[4-(2-cyanophenyl)phenyl]methyl-pentanoyl-amino]acetate CAS Name: 2-[[4-(2-cyanophenyl)phenyl]methyl-(1-oxopentyl)amino]acetic acid methyl ester IUPAC Name: methyl 2-[[4-(2-cyanophenyl)phenyl]methyl-pentanoylamino]acetate Traditional Name: 2-[[4-(2-cyanophenyl)benzyl]-valeryl-amino]acetic acid methyl ester Formula: C22H24N2O3 MolecularWeight: 364.43756

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)N(CC1=CC=C(C=C1)C2=CC=CC=C2C#N)CC(=O)OC

Isomeric SMILES

CCCCC(=O)N(CC1=CC=C(C=C1)C2=CC=CC=C2C#N)CC(=O)OC

InChI

InChI=1S/C22H24N2O3/c1-3-4-9-21(25)24(16-22(26)27-2)15-17-10-12-18(13-11-17)20-8-6-5-7-19(20)14-23/h5-8,10-13H,3-4,9,15-16H2,1-2H3