[3-(azepan-1-ylsulfonyl)-4-chloranyl-phenyl]-(3-methylpiperidin-1-yl)methanone

Systemtic Name: [3-(azepan-1-ylsulfonyl)-4-chloranyl-phenyl]-(3-methylpiperidin-1-yl)methanone Openeye Name: [3-(azepan-1-ylsulfonyl)-4-chloro-phenyl]-(3-methyl-1-piperidyl)methanone CAS Name: [3-(1-azepanylsulfonyl)-4-chlorophenyl]-(3-methyl-1-piperidinyl)methanone IUPAC Name: [3-(azepan-1-ylsulfonyl)-4-chlorophenyl]-(3-methylpiperidin-1-yl)methanone Traditional Name: [3-(azepan-1-ylsulfonyl)-4-chloro-phenyl]-(3-methylpiperidino)methanone Formula: C19H27ClN2O3S MolecularWeight: 398.94728

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CC1CCCN(C1)C(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C19H27ClN2O3S/c1-15-7-6-10-21(14-15)19(23)16-8-9-17(20)18(13-16)26(24,25)22-11-4-2-3-5-12-22/h8-9,13,15H,2-7,10-12,14H2,1H3