N-[3-[4-(azepan-1-yl)phenyl]propyl]-3-methyl-benzenesulfonamide

Systemtic Name: N-[3-[4-(azepan-1-yl)phenyl]propyl]-3-methyl-benzenesulfonamide Openeye Name: N-[3-[4-(azepan-1-yl)phenyl]propyl]-3-methyl-benzenesulfonamide CAS Name: N-[3-[4-(1-azepanyl)phenyl]propyl]-3-methylbenzenesulfonamide IUPAC Name: N-[3-[4-(azepan-1-yl)phenyl]propyl]-3-methylbenzenesulfonamide Traditional Name: N-[3-[4-(azepan-1-yl)phenyl]propyl]-3-methyl-benzenesulfonamide Formula: C22H30N2O2S MolecularWeight: 386.5508

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)S(=O)(=O)NCCCC2=CC=C(C=C2)N3CCCCCC3

Isomeric SMILES

CC1=CC(=CC=C1)S(=O)(=O)NCCCC2=CC=C(C=C2)N3CCCCCC3

InChI

InChI=1S/C22H30N2O2S/c1-19-8-6-10-22(18-19)27(25,26)23-15-7-9-20-11-13-21(14-12-20)24-16-4-2-3-5-17-24/h6,8,10-14,18,23H,2-5,7,9,15-17H2,1H3