4-[5-[(2-ethenyl-1-methoxycarbonyl-cyclopropyl)carbamoyl]-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidin-3-yl]oxy-7-methoxy-quinoline-2-carboxylic acid

Systemtic Name: 4-[5-[(2-ethenyl-1-methoxycarbonyl-cyclopropyl)carbamoyl]-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidin-3-yl]oxy-7-methoxy-quinoline-2-carboxylic acid Openeye Name: 4-[1-tert-butoxycarbonyl-5-[(1-methoxycarbonyl-2-vinyl-cyclopropyl)carbamoyl]pyrrolidin-3-yl]oxy-7-methoxy-quinoline-2-carboxylic acid CAS Name: 4-[[5-[[(2-ethenyl-1-methoxycarbonylcyclopropyl)amino]-oxomethyl]-1-[(2-methylpropan-2-yl)oxy-oxomethyl]-3-pyrrolidinyl]oxy]-7-methoxy-2-quinolinecarboxylic acid IUPAC Name: 4-[5-[(2-ethenyl-1-methoxycarbonylcyclopropyl)carbamoyl]-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidin-3-yl]oxy-7-methoxyquinoline-2-carboxylic acid Traditional Name: 4-[1-tert-butoxycarbonyl-5-[(1-carbomethoxy-2-vinyl-cyclopropyl)carbamoyl]pyrrolidin-3-yl]oxy-7-methoxy-quinaldic acid Formula: C28H33N3O9 MolecularWeight: 555.57632

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CC(CC1C(=O)NC2(CC2C=C)C(=O)OC)OC3=CC(=NC4=C3C=CC(=C4)OC)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)N1CC(CC1C(=O)NC2(CC2C=C)C(=O)OC)OC3=CC(=NC4=C3C=CC(=C4)OC)C(=O)O

InChI

InChI=1S/C28H33N3O9/c1-7-15-13-28(15,25(35)38-6)30-23(32)21-11-17(14-31(21)26(36)40-27(2,3)4)39-22-12-20(24(33)34)29-19-10-16(37-5)8-9-18(19)22/h7-10,12,15,17,21H,1,11,13-14H2,2-6H3,(H,30,32)(H,33,34)