(phenylmethyl) 4-methyl-2-[2-[4-[(2-methylphenyl)carbamoylamino]phenyl]ethanoylamino]pentanoate

Systemtic Name: (phenylmethyl) 4-methyl-2-[2-[4-[(2-methylphenyl)carbamoylamino]phenyl]ethanoylamino]pentanoate Openeye Name: benzyl 4-methyl-2-[[2-[4-(o-tolylcarbamoylamino)phenyl]acetyl]amino]pentanoate CAS Name: 4-methyl-2-[[2-[4-[[(2-methylanilino)-oxomethyl]amino]phenyl]-1-oxoethyl]amino]pentanoic acid (phenylmethyl) ester IUPAC Name: benzyl 4-methyl-2-[[2-[4-[(2-methylphenyl)carbamoylamino]phenyl]acetyl]amino]pentanoate Traditional Name: 4-methyl-2-[[2-[4-(o-tolylcarbamoylamino)phenyl]acetyl]amino]valeric acid benzyl ester Formula: C29H33N3O4 MolecularWeight: 487.59002

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)NC2=CC=C(C=C2)CC(=O)NC(CC(C)C)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC1=CC=CC=C1NC(=O)NC2=CC=C(C=C2)CC(=O)NC(CC(C)C)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C29H33N3O4/c1-20(2)17-26(28(34)36-19-23-10-5-4-6-11-23)31-27(33)18-22-13-15-24(16-14-22)30-29(35)32-25-12-8-7-9-21(25)3/h4-16,20,26H,17-19H2,1-3H3,(H,31,33)(H2,30,32,35)