3-[[1-cyclopropylcarbonyl-3-[(4-methoxyphenyl)carbamoyl]imidazolidin-2-yl]carbonylamino]-3-(3-nitrophenyl)propanoic acid

Systemtic Name: 3-[[1-cyclopropylcarbonyl-3-[(4-methoxyphenyl)carbamoyl]imidazolidin-2-yl]carbonylamino]-3-(3-nitrophenyl)propanoic acid Openeye Name: 3-[[1-(cyclopropanecarbonyl)-3-[(4-methoxyphenyl)carbamoyl]imidazolidine-2-carbonyl]amino]-3-(3-nitrophenyl)propanoic acid CAS Name: 3-[[[1-[cyclopropyl(oxo)methyl]-3-[(4-methoxyanilino)-oxomethyl]-2-imidazolidinyl]-oxomethyl]amino]-3-(3-nitrophenyl)propanoic acid IUPAC Name: 3-[[1-(cyclopropanecarbonyl)-3-[(4-methoxyphenyl)carbamoyl]imidazolidine-2-carbonyl]amino]-3-(3-nitrophenyl)propanoic acid Traditional Name: 3-[[1-(cyclopropanecarbonyl)-3-[(4-methoxyphenyl)carbamoyl]imidazolidine-2-carbonyl]amino]-3-(3-nitrophenyl)propionic acid Formula: C25H27N5O8 MolecularWeight: 525.51058

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)N2CCN(C2C(=O)NC(CC(=O)O)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)C4CC4

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)N2CCN(C2C(=O)NC(CC(=O)O)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)C4CC4

InChI

InChI=1S/C25H27N5O8/c1-38-19-9-7-17(8-10-19)26-25(35)29-12-11-28(24(34)15-5-6-15)23(29)22(33)27-20(14-21(31)32)16-3-2-4-18(13-16)30(36)37/h2-4,7-10,13,15,20,23H,5-6,11-12,14H2,1H3,(H,26,35)(H,27,33)(H,31,32)