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

Systemtic Name: methyl 2-[[4-(2-cyanophenyl)phenyl]methyl-pentanoyl-amino]propanoate Openeye Name: methyl 2-[[4-(2-cyanophenyl)phenyl]methyl-pentanoyl-amino]propanoate CAS Name: 2-[[4-(2-cyanophenyl)phenyl]methyl-(1-oxopentyl)amino]propanoic acid methyl ester IUPAC Name: methyl 2-[[4-(2-cyanophenyl)phenyl]methyl-pentanoylamino]propanoate Traditional Name: 2-[[4-(2-cyanophenyl)benzyl]-valeryl-amino]propionic acid methyl ester Formula: C23H26N2O3 MolecularWeight: 378.46414

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H26N2O3/c1-4-5-10-22(26)25(17(2)23(27)28-3)16-18-11-13-19(14-12-18)21-9-7-6-8-20(21)15-24/h6-9,11-14,17H,4-5,10,16H2,1-3H3