4-bromanyl-N-(2-methoxyethyl)-3-[4-(phenylmethyl)piperidin-1-yl]carbonyl-benzenesulfonamide

Systemtic Name: 4-bromanyl-N-(2-methoxyethyl)-3-[4-(phenylmethyl)piperidin-1-yl]carbonyl-benzenesulfonamide Openeye Name: 3-(4-benzylpiperidine-1-carbonyl)-4-bromo-N-(2-methoxyethyl)benzenesulfonamide CAS Name: 4-bromo-N-(2-methoxyethyl)-3-[oxo-[4-(phenylmethyl)-1-piperidinyl]methyl]benzenesulfonamide IUPAC Name: 3-(4-benzylpiperidine-1-carbonyl)-4-bromo-N-(2-methoxyethyl)benzenesulfonamide Traditional Name: 3-(4-benzylpiperidine-1-carbonyl)-4-bromo-N-(2-methoxyethyl)benzenesulfonamide Formula: C22H27BrN2O4S MolecularWeight: 495.42978

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Descriptors Computed from Structure

Canonical SMILES:

COCCNS(=O)(=O)C1=CC(=C(C=C1)Br)C(=O)N2CCC(CC2)CC3=CC=CC=C3

Isomeric SMILES

COCCNS(=O)(=O)C1=CC(=C(C=C1)Br)C(=O)N2CCC(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C22H27BrN2O4S/c1-29-14-11-24-30(27,28)19-7-8-21(23)20(16-19)22(26)25-12-9-18(10-13-25)15-17-5-3-2-4-6-17/h2-8,16,18,24H,9-15H2,1H3