ethyl 1-ethyl-4-oxidanylidene-6-[(4-piperidin-1-ylsulfonylphenyl)carbonylamino]quinoline-3-carboxylate

Systemtic Name: ethyl 1-ethyl-4-oxidanylidene-6-[(4-piperidin-1-ylsulfonylphenyl)carbonylamino]quinoline-3-carboxylate Openeye Name: ethyl 1-ethyl-4-oxo-6-[[4-(1-piperidylsulfonyl)benzoyl]amino]quinoline-3-carboxylate CAS Name: 1-ethyl-4-oxo-6-[[oxo-[4-(1-piperidinylsulfonyl)phenyl]methyl]amino]-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-ethyl-4-oxo-6-[(4-piperidin-1-ylsulfonylbenzoyl)amino]quinoline-3-carboxylate Traditional Name: 1-ethyl-4-keto-6-[(4-piperidinosulfonylbenzoyl)amino]quinoline-3-carboxylic acid ethyl ester Formula: C26H29N3O6S MolecularWeight: 511.58996

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=C1C=CC(=C2)NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCCC4)C(=O)OCC

Isomeric SMILES

CCN1C=C(C(=O)C2=C1C=CC(=C2)NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCCC4)C(=O)OCC

InChI

InChI=1S/C26H29N3O6S/c1-3-28-17-22(26(32)35-4-2)24(30)21-16-19(10-13-23(21)28)27-25(31)18-8-11-20(12-9-18)36(33,34)29-14-6-5-7-15-29/h8-13,16-17H,3-7,14-15H2,1-2H3,(H,27,31)