1-cyclopropyl-7-[4-(3-methoxy-3-oxidanylidene-propyl)piperazin-1-yl]-6-nitro-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 1-cyclopropyl-7-[4-(3-methoxy-3-oxidanylidene-propyl)piperazin-1-yl]-6-nitro-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-7-[4-(3-methoxy-3-oxo-propyl)piperazin-1-yl]-6-nitro-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-7-[4-(3-methoxy-3-oxopropyl)-1-piperazinyl]-6-nitro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-7-[4-(3-methoxy-3-oxopropyl)piperazin-1-yl]-6-nitro-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-cyclopropyl-4-keto-7-[4-(3-keto-3-methoxy-propyl)piperazino]-6-nitro-quinoline-3-carboxylic acid Formula: C21H24N4O7 MolecularWeight: 444.43786

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCN1CCN(CC1)C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)C4CC4)[N+](=O)[O-]

Isomeric SMILES

COC(=O)CCN1CCN(CC1)C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)C4CC4)[N+](=O)[O-]

InChI

InChI=1S/C21H24N4O7/c1-32-19(26)4-5-22-6-8-23(9-7-22)17-11-16-14(10-18(17)25(30)31)20(27)15(21(28)29)12-24(16)13-2-3-13/h10-13H,2-9H2,1H3,(H,28,29)