1-[2-[[1-(4-ethoxycarbonylpiperazin-1-yl)-5-oxidanyl-1,5-bis(oxidanylidene)pentan-2-yl]carbamoyl]-7-nitro-quinolin-4-yl]oxycyclobutane-1-carboxylic acid

Systemtic Name: 1-[2-[[1-(4-ethoxycarbonylpiperazin-1-yl)-5-oxidanyl-1,5-bis(oxidanylidene)pentan-2-yl]carbamoyl]-7-nitro-quinolin-4-yl]oxycyclobutane-1-carboxylic acid Openeye Name: 1-[[2-[[1-(4-ethoxycarbonylpiperazine-1-carbonyl)-4-hydroxy-4-oxo-butyl]carbamoyl]-7-nitro-4-quinolyl]oxy]cyclobutanecarboxylic acid CAS Name: 1-[[2-[[[1-(4-ethoxycarbonyl-1-piperazinyl)-5-hydroxy-1,5-dioxopentan-2-yl]amino]-oxomethyl]-7-nitro-4-quinolinyl]oxy]-1-cyclobutanecarboxylic acid IUPAC Name: 1-[2-[[1-(4-ethoxycarbonylpiperazin-1-yl)-5-hydroxy-1,5-dioxopentan-2-yl]carbamoyl]-7-nitroquinolin-4-yl]oxycyclobutane-1-carboxylic acid Traditional Name: 1-[[2-[[1-(4-carbethoxypiperazine-1-carbonyl)-4-hydroxy-4-keto-butyl]carbamoyl]-7-nitro-4-quinolyl]oxy]cyclobutanecarboxylic acid Formula: C27H31N5O11 MolecularWeight: 601.56194

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C(CCC(=O)O)NC(=O)C2=NC3=C(C=CC(=C3)[N+](=O)[O-])C(=C2)OC4(CCC4)C(=O)O

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C(CCC(=O)O)NC(=O)C2=NC3=C(C=CC(=C3)[N+](=O)[O-])C(=C2)OC4(CCC4)C(=O)O

InChI

InChI=1S/C27H31N5O11/c1-2-42-26(39)31-12-10-30(11-13-31)24(36)18(6-7-22(33)34)29-23(35)20-15-21(43-27(25(37)38)8-3-9-27)17-5-4-16(32(40)41)14-19(17)28-20/h4-5,14-15,18H,2-3,6-13H2,1H3,(H,29,35)(H,33,34)(H,37,38)