azepan-1-yl-[1-(phenylsulfonyl)-3,4-dihydro-2H-quinolin-6-yl]methanone

Systemtic Name: azepan-1-yl-[1-(phenylsulfonyl)-3,4-dihydro-2H-quinolin-6-yl]methanone Openeye Name: azepan-1-yl-[1-(benzenesulfonyl)-3,4-dihydro-2H-quinolin-6-yl]methanone CAS Name: 1-azepanyl-[1-(benzenesulfonyl)-3,4-dihydro-2H-quinolin-6-yl]methanone IUPAC Name: azepan-1-yl-[1-(benzenesulfonyl)-3,4-dihydro-2H-quinolin-6-yl]methanone Traditional Name: azepan-1-yl-(1-besyl-3,4-dihydro-2H-quinolin-6-yl)methanone Formula: C22H26N2O3S MolecularWeight: 398.51844

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2=CC3=C(C=C2)N(CCC3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CCCN(CC1)C(=O)C2=CC3=C(C=C2)N(CCC3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C22H26N2O3S/c25-22(23-14-6-1-2-7-15-23)19-12-13-21-18(17-19)9-8-16-24(21)28(26,27)20-10-4-3-5-11-20/h3-5,10-13,17H,1-2,6-9,14-16H2