3-acetamido-3-[3-[methyl-[2-[4-[[methyl-(2-methylphenyl)carbamoyl]amino]phenyl]ethanoyl]amino]phenyl]propanoic acid

Systemtic Name: 3-acetamido-3-[3-[methyl-[2-[4-[[methyl-(2-methylphenyl)carbamoyl]amino]phenyl]ethanoyl]amino]phenyl]propanoic acid Openeye Name: 3-acetamido-3-[3-[methyl-[2-[4-[[methyl(o-tolyl)carbamoyl]amino]phenyl]acetyl]amino]phenyl]propanoic acid CAS Name: 3-acetamido-3-[3-[[2-[4-[[(N,2-dimethylanilino)-oxomethyl]amino]phenyl]-1-oxoethyl]-methylamino]phenyl]propanoic acid IUPAC Name: 3-acetamido-3-[3-[methyl-[2-[4-[[methyl-(2-methylphenyl)carbamoyl]amino]phenyl]acetyl]amino]phenyl]propanoic acid Traditional Name: 3-acetamido-3-[3-[methyl-[2-[4-[[methyl(o-tolyl)carbamoyl]amino]phenyl]acetyl]amino]phenyl]propionic acid Formula: C29H32N4O5 MolecularWeight: 516.58818

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N(C)C(=O)NC2=CC=C(C=C2)CC(=O)N(C)C3=CC=CC(=C3)C(CC(=O)O)NC(=O)C

Isomeric SMILES

CC1=CC=CC=C1N(C)C(=O)NC2=CC=C(C=C2)CC(=O)N(C)C3=CC=CC(=C3)C(CC(=O)O)NC(=O)C

InChI

InChI=1S/C29H32N4O5/c1-19-8-5-6-11-26(19)33(4)29(38)31-23-14-12-21(13-15-23)16-27(35)32(3)24-10-7-9-22(17-24)25(18-28(36)37)30-20(2)34/h5-15,17,25H,16,18H2,1-4H3,(H,30,34)(H,31,38)(H,36,37)