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

Systemtic Name: 1-cyclopropyl-6-fluoranyl-7-[4-(3-methoxy-3-oxidanylidene-propyl)-3-phenyl-piperazin-1-yl]-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-6-fluoro-7-[4-(3-methoxy-3-oxo-propyl)-3-phenyl-piperazin-1-yl]-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-6-fluoro-7-[4-(3-methoxy-3-oxopropyl)-3-phenyl-1-piperazinyl]-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-6-fluoro-7-[4-(3-methoxy-3-oxopropyl)-3-phenylpiperazin-1-yl]-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-cyclopropyl-6-fluoro-4-keto-7-[4-(3-keto-3-methoxy-propyl)-3-phenyl-piperazino]quinoline-3-carboxylic acid Formula: C27H28FN3O5 MolecularWeight: 493.526723

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCN1CCN(CC1C2=CC=CC=C2)C3=C(C=C4C(=C3)N(C=C(C4=O)C(=O)O)C5CC5)F

Isomeric SMILES

COC(=O)CCN1CCN(CC1C2=CC=CC=C2)C3=C(C=C4C(=C3)N(C=C(C4=O)C(=O)O)C5CC5)F

InChI

InChI=1S/C27H28FN3O5/c1-36-25(32)9-10-29-11-12-30(16-24(29)17-5-3-2-4-6-17)23-14-22-19(13-21(23)28)26(33)20(27(34)35)15-31(22)18-7-8-18/h2-6,13-15,18,24H,7-12,16H2,1H3,(H,34,35)