3-[[3-benzamido-4-(4-methoxycarbonylpiperazin-1-yl)phenyl]carbonylamino]-3-(4-methylphenyl)propanoic acid

Systemtic Name: 3-[[3-benzamido-4-(4-methoxycarbonylpiperazin-1-yl)phenyl]carbonylamino]-3-(4-methylphenyl)propanoic acid Openeye Name: 3-[[3-benzamido-4-(4-methoxycarbonylpiperazin-1-yl)benzoyl]amino]-3-(p-tolyl)propanoic acid CAS Name: 3-[[[3-benzamido-4-(4-methoxycarbonyl-1-piperazinyl)phenyl]-oxomethyl]amino]-3-(4-methylphenyl)propanoic acid IUPAC Name: 3-[[3-benzamido-4-(4-methoxycarbonylpiperazin-1-yl)benzoyl]amino]-3-(4-methylphenyl)propanoic acid Traditional Name: 3-[[3-benzamido-4-(4-carbomethoxypiperazino)benzoyl]amino]-3-(p-tolyl)propionic acid Formula: C30H32N4O6 MolecularWeight: 544.59828

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(CC(=O)O)NC(=O)C2=CC(=C(C=C2)N3CCN(CC3)C(=O)OC)NC(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C(CC(=O)O)NC(=O)C2=CC(=C(C=C2)N3CCN(CC3)C(=O)OC)NC(=O)C4=CC=CC=C4

InChI

InChI=1S/C30H32N4O6/c1-20-8-10-21(11-9-20)24(19-27(35)36)31-29(38)23-12-13-26(33-14-16-34(17-15-33)30(39)40-2)25(18-23)32-28(37)22-6-4-3-5-7-22/h3-13,18,24H,14-17,19H2,1-2H3,(H,31,38)(H,32,37)(H,35,36)