7-[(4Z)-3-(aminomethyl)-4-phenylmethoxyimino-pyrrolidin-1-yl]-1-cyclopropyl-6-fluoranyl-8-methoxy-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 7-[(4Z)-3-(aminomethyl)-4-phenylmethoxyimino-pyrrolidin-1-yl]-1-cyclopropyl-6-fluoranyl-8-methoxy-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-[(4Z)-3-(aminomethyl)-4-benzyloxyimino-pyrrolidin-1-yl]-1-cyclopropyl-6-fluoro-8-methoxy-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-[(4Z)-3-(aminomethyl)-4-phenylmethoxyimino-1-pyrrolidinyl]-1-cyclopropyl-6-fluoro-8-methoxy-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-[(4Z)-3-(aminomethyl)-4-phenylmethoxyiminopyrrolidin-1-yl]-1-cyclopropyl-6-fluoro-8-methoxy-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-[(4Z)-3-(aminomethyl)-4-benzyloximino-pyrrolidino]-1-cyclopropyl-6-fluoro-4-keto-8-methoxy-quinoline-3-carboxylic acid Formula: C26H27FN4O5 MolecularWeight: 494.514783

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=CC(=C1N3CC(C(=NOCC4=CC=CC=C4)C3)CN)F)C(=O)C(=CN2C5CC5)C(=O)O

Isomeric SMILES

COC1=C2C(=CC(=C1N3CC(/C(=N/OCC4=CC=CC=C4)/C3)CN)F)C(=O)C(=CN2C5CC5)C(=O)O

InChI

InChI=1S/C26H27FN4O5/c1-35-25-22-18(24(32)19(26(33)34)12-31(22)17-7-8-17)9-20(27)23(25)30-11-16(10-28)21(13-30)29-36-14-15-5-3-2-4-6-15/h2-6,9,12,16-17H,7-8,10-11,13-14,28H2,1H3,(H,33,34)/b29-21+