3-[[4-(4-cyclopropylcarbonylpiperazin-1-yl)-3-nitro-phenyl]carbonylamino]-3-(4-fluorophenyl)propanoic acid

Systemtic Name: 3-[[4-(4-cyclopropylcarbonylpiperazin-1-yl)-3-nitro-phenyl]carbonylamino]-3-(4-fluorophenyl)propanoic acid Openeye Name: 3-[[4-[4-(cyclopropanecarbonyl)piperazin-1-yl]-3-nitro-benzoyl]amino]-3-(4-fluorophenyl)propanoic acid CAS Name: 3-[[[4-[4-[cyclopropyl(oxo)methyl]-1-piperazinyl]-3-nitrophenyl]-oxomethyl]amino]-3-(4-fluorophenyl)propanoic acid IUPAC Name: 3-[[4-[4-(cyclopropanecarbonyl)piperazin-1-yl]-3-nitrobenzoyl]amino]-3-(4-fluorophenyl)propanoic acid Traditional Name: 3-[[4-[4-(cyclopropanecarbonyl)piperazino]-3-nitro-benzoyl]amino]-3-(4-fluorophenyl)propionic acid Formula: C24H25FN4O6 MolecularWeight: 484.476903

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)N2CCN(CC2)C3=C(C=C(C=C3)C(=O)NC(CC(=O)O)C4=CC=C(C=C4)F)[N+](=O)[O-]

Isomeric SMILES

C1CC1C(=O)N2CCN(CC2)C3=C(C=C(C=C3)C(=O)NC(CC(=O)O)C4=CC=C(C=C4)F)[N+](=O)[O-]

InChI

InChI=1S/C24H25FN4O6/c25-18-6-3-15(4-7-18)19(14-22(30)31)26-23(32)17-5-8-20(21(13-17)29(34)35)27-9-11-28(12-10-27)24(33)16-1-2-16/h3-8,13,16,19H,1-2,9-12,14H2,(H,26,32)(H,30,31)