1-methylsulfonyl-N-[3-(2-oxidanylideneazepan-1-yl)propyl]-3,4-dihydro-2H-quinoline-6-carboxamide

Systemtic Name: 1-methylsulfonyl-N-[3-(2-oxidanylideneazepan-1-yl)propyl]-3,4-dihydro-2H-quinoline-6-carboxamide Openeye Name: 1-methylsulfonyl-N-[3-(2-oxoazepan-1-yl)propyl]-3,4-dihydro-2H-quinoline-6-carboxamide CAS Name: 1-methylsulfonyl-N-[3-(2-oxo-1-azepanyl)propyl]-3,4-dihydro-2H-quinoline-6-carboxamide IUPAC Name: 1-methylsulfonyl-N-[3-(2-oxoazepan-1-yl)propyl]-3,4-dihydro-2H-quinoline-6-carboxamide Traditional Name: N-[3-(2-ketoazepan-1-yl)propyl]-1-mesyl-3,4-dihydro-2H-quinoline-6-carboxamide Formula: C20H29N3O4S MolecularWeight: 407.52696

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCCC2=C1C=CC(=C2)C(=O)NCCCN3CCCCCC3=O

Isomeric SMILES

CS(=O)(=O)N1CCCC2=C1C=CC(=C2)C(=O)NCCCN3CCCCCC3=O

InChI

InChI=1S/C20H29N3O4S/c1-28(26,27)23-14-5-7-16-15-17(9-10-18(16)23)20(25)21-11-6-13-22-12-4-2-3-8-19(22)24/h9-10,15H,2-8,11-14H2,1H3,(H,21,25)