1-cyclopropyl-7-[4-(2,3-dihydro-1,4-benzodioxin-3-ylcarbonyl)piperazin-1-yl]-8-methyl-6-nitro-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 1-cyclopropyl-7-[4-(2,3-dihydro-1,4-benzodioxin-3-ylcarbonyl)piperazin-1-yl]-8-methyl-6-nitro-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-7-[4-(2,3-dihydro-1,4-benzodioxine-3-carbonyl)piperazin-1-yl]-8-methyl-6-nitro-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-7-[4-[2,3-dihydro-1,4-benzodioxin-3-yl(oxo)methyl]-1-piperazinyl]-8-methyl-6-nitro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-7-[4-(2,3-dihydro-1,4-benzodioxine-3-carbonyl)piperazin-1-yl]-8-methyl-6-nitro-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-cyclopropyl-7-[4-(2,3-dihydro-1,4-benzodioxin-3-carbonyl)piperazino]-4-keto-8-methyl-6-nitro-quinoline-3-carboxylic acid Formula: C27H26N4O8 MolecularWeight: 534.51734

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1N3CCN(CC3)C(=O)C4COC5=CC=CC=C5O4)[N+](=O)[O-])C(=O)C(=CN2C6CC6)C(=O)O

Isomeric SMILES

CC1=C2C(=CC(=C1N3CCN(CC3)C(=O)C4COC5=CC=CC=C5O4)[N+](=O)[O-])C(=O)C(=CN2C6CC6)C(=O)O

InChI

InChI=1S/C27H26N4O8/c1-15-23-17(25(32)18(27(34)35)13-30(23)16-6-7-16)12-19(31(36)37)24(15)28-8-10-29(11-9-28)26(33)22-14-38-20-4-2-3-5-21(20)39-22/h2-5,12-13,16,22H,6-11,14H2,1H3,(H,34,35)