4-acetamido-4-[3-[2-[3-methoxy-4-[[methyl-(2-methylphenyl)carbamoyl]amino]phenyl]ethanoylamino]phenyl]butanoic acid

Systemtic Name: 4-acetamido-4-[3-[2-[3-methoxy-4-[[methyl-(2-methylphenyl)carbamoyl]amino]phenyl]ethanoylamino]phenyl]butanoic acid Openeye Name: 4-acetamido-4-[3-[[2-[3-methoxy-4-[[methyl(o-tolyl)carbamoyl]amino]phenyl]acetyl]amino]phenyl]butanoic acid CAS Name: 4-acetamido-4-[3-[[2-[4-[[(N,2-dimethylanilino)-oxomethyl]amino]-3-methoxyphenyl]-1-oxoethyl]amino]phenyl]butanoic acid IUPAC Name: 4-acetamido-4-[3-[[2-[3-methoxy-4-[[methyl-(2-methylphenyl)carbamoyl]amino]phenyl]acetyl]amino]phenyl]butanoic acid Traditional Name: 4-acetamido-4-[3-[[2-[3-methoxy-4-[[methyl(o-tolyl)carbamoyl]amino]phenyl]acetyl]amino]phenyl]butyric acid Formula: C30H34N4O6 MolecularWeight: 546.61416

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N(C)C(=O)NC2=C(C=C(C=C2)CC(=O)NC3=CC=CC(=C3)C(CCC(=O)O)NC(=O)C)OC

Isomeric SMILES

CC1=CC=CC=C1N(C)C(=O)NC2=C(C=C(C=C2)CC(=O)NC3=CC=CC(=C3)C(CCC(=O)O)NC(=O)C)OC

InChI

InChI=1S/C30H34N4O6/c1-19-8-5-6-11-26(19)34(3)30(39)33-25-13-12-21(16-27(25)40-4)17-28(36)32-23-10-7-9-22(18-23)24(31-20(2)35)14-15-29(37)38/h5-13,16,18,24H,14-15,17H2,1-4H3,(H,31,35)(H,32,36)(H,33,39)(H,37,38)