[3-(azepan-1-ylsulfonyl)phenyl]-(3,5-dimethylpiperidin-1-yl)methanone

Systemtic Name: [3-(azepan-1-ylsulfonyl)phenyl]-(3,5-dimethylpiperidin-1-yl)methanone Openeye Name: [3-(azepan-1-ylsulfonyl)phenyl]-(3,5-dimethyl-1-piperidyl)methanone CAS Name: [3-(1-azepanylsulfonyl)phenyl]-(3,5-dimethyl-1-piperidinyl)methanone IUPAC Name: [3-(azepan-1-ylsulfonyl)phenyl]-(3,5-dimethylpiperidin-1-yl)methanone Traditional Name: [3-(azepan-1-ylsulfonyl)phenyl]-(3,5-dimethylpiperidino)methanone Formula: C20H30N2O3S MolecularWeight: 378.5288

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)C(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCCCC3)C

Isomeric SMILES

CC1CC(CN(C1)C(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCCCC3)C

InChI

InChI=1S/C20H30N2O3S/c1-16-12-17(2)15-21(14-16)20(23)18-8-7-9-19(13-18)26(24,25)22-10-5-3-4-6-11-22/h7-9,13,16-17H,3-6,10-12,14-15H2,1-2H3