ethyl 7-(cyclohexylamino)-1-(1,3-diacetamidopropan-2-yl)-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylate

Systemtic Name: ethyl 7-(cyclohexylamino)-1-(1,3-diacetamidopropan-2-yl)-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylate Openeye Name: ethyl 1-[2-acetamido-1-(acetamidomethyl)ethyl]-7-(cyclohexylamino)-6-fluoro-4-oxo-quinoline-3-carboxylate CAS Name: 7-(cyclohexylamino)-1-(1,3-diacetamidopropan-2-yl)-6-fluoro-4-oxo-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 7-(cyclohexylamino)-1-(1,3-diacetamidopropan-2-yl)-6-fluoro-4-oxoquinoline-3-carboxylate Traditional Name: 1-[2-acetamido-1-(acetamidomethyl)ethyl]-7-(cyclohexylamino)-6-fluoro-4-keto-quinoline-3-carboxylic acid ethyl ester Formula: C25H33FN4O5 MolecularWeight: 488.551723

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN(C2=CC(=C(C=C2C1=O)F)NC3CCCCC3)C(CNC(=O)C)CNC(=O)C

Isomeric SMILES

CCOC(=O)C1=CN(C2=CC(=C(C=C2C1=O)F)NC3CCCCC3)C(CNC(=O)C)CNC(=O)C

InChI

InChI=1S/C25H33FN4O5/c1-4-35-25(34)20-14-30(18(12-27-15(2)31)13-28-16(3)32)23-11-22(21(26)10-19(23)24(20)33)29-17-8-6-5-7-9-17/h10-11,14,17-18,29H,4-9,12-13H2,1-3H3,(H,27,31)(H,28,32)