methyl 3-[2-[4-[(4-methylpyridin-2-yl)amino]butanoylamino]ethanoylamino]-3-(4-naphthalen-2-ylphenyl)propanoate

Systemtic Name: methyl 3-[2-[4-[(4-methylpyridin-2-yl)amino]butanoylamino]ethanoylamino]-3-(4-naphthalen-2-ylphenyl)propanoate Openeye Name: methyl 3-[[2-[4-[(4-methyl-2-pyridyl)amino]butanoylamino]acetyl]amino]-3-[4-(2-naphthyl)phenyl]propanoate CAS Name: 3-[[2-[[4-[(4-methyl-2-pyridinyl)amino]-1-oxobutyl]amino]-1-oxoethyl]amino]-3-[4-(2-naphthalenyl)phenyl]propanoic acid methyl ester IUPAC Name: methyl 3-[[2-[4-[(4-methylpyridin-2-yl)amino]butanoylamino]acetyl]amino]-3-(4-naphthalen-2-ylphenyl)propanoate Traditional Name: 3-[[2-[4-[(4-methyl-2-pyridyl)amino]butanoylamino]acetyl]amino]-3-[4-(2-naphthyl)phenyl]propionic acid methyl ester Formula: C32H34N4O4 MolecularWeight: 538.63676

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC=C1)NCCCC(=O)NCC(=O)NC(CC(=O)OC)C2=CC=C(C=C2)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

CC1=CC(=NC=C1)NCCCC(=O)NCC(=O)NC(CC(=O)OC)C2=CC=C(C=C2)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C32H34N4O4/c1-22-15-17-34-29(18-22)33-16-5-8-30(37)35-21-31(38)36-28(20-32(39)40-2)25-12-9-24(10-13-25)27-14-11-23-6-3-4-7-26(23)19-27/h3-4,6-7,9-15,17-19,28H,5,8,16,20-21H2,1-2H3,(H,33,34)(H,35,37)(H,36,38)