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

Systemtic Name: [6-(azepan-1-ylsulfonyl)-3,4-dihydro-2H-quinolin-1-yl]-(3-chlorophenyl)methanone Openeye Name: [6-(azepan-1-ylsulfonyl)-3,4-dihydro-2H-quinolin-1-yl]-(3-chlorophenyl)methanone CAS Name: [6-(1-azepanylsulfonyl)-3,4-dihydro-2H-quinolin-1-yl]-(3-chlorophenyl)methanone IUPAC Name: [6-(azepan-1-ylsulfonyl)-3,4-dihydro-2H-quinolin-1-yl]-(3-chlorophenyl)methanone Traditional Name: [6-(azepan-1-ylsulfonyl)-3,4-dihydro-2H-quinolin-1-yl]-(3-chlorophenyl)methanone Formula: C22H25ClN2O3S MolecularWeight: 432.9635

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H25ClN2O3S/c23-19-9-5-7-18(15-19)22(26)25-14-6-8-17-16-20(10-11-21(17)25)29(27,28)24-12-3-1-2-4-13-24/h5,7,9-11,15-16H,1-4,6,8,12-14H2