4-bromanyl-N-[2-(4-methoxyphenyl)-2-piperidin-1-yl-ethyl]-3-methyl-benzenesulfonamide

Systemtic Name: 4-bromanyl-N-[2-(4-methoxyphenyl)-2-piperidin-1-yl-ethyl]-3-methyl-benzenesulfonamide Openeye Name: 4-bromo-N-[2-(4-methoxyphenyl)-2-(1-piperidyl)ethyl]-3-methyl-benzenesulfonamide CAS Name: 4-bromo-N-[2-(4-methoxyphenyl)-2-(1-piperidinyl)ethyl]-3-methylbenzenesulfonamide IUPAC Name: 4-bromo-N-[2-(4-methoxyphenyl)-2-piperidin-1-ylethyl]-3-methylbenzenesulfonamide Traditional Name: 4-bromo-N-[2-(4-methoxyphenyl)-2-piperidino-ethyl]-3-methyl-benzenesulfonamide Formula: C21H27BrN2O3S MolecularWeight: 467.41968

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)S(=O)(=O)NCC(C2=CC=C(C=C2)OC)N3CCCCC3)Br

Isomeric SMILES

CC1=C(C=CC(=C1)S(=O)(=O)NCC(C2=CC=C(C=C2)OC)N3CCCCC3)Br

InChI

InChI=1S/C21H27BrN2O3S/c1-16-14-19(10-11-20(16)22)28(25,26)23-15-21(24-12-4-3-5-13-24)17-6-8-18(27-2)9-7-17/h6-11,14,21,23H,3-5,12-13,15H2,1-2H3