5-bromanyl-N-ethyl-2-methoxy-N-[1-(phenylmethyl)pyrrolidin-3-yl]benzenesulfonamide

Systemtic Name: 5-bromanyl-N-ethyl-2-methoxy-N-[1-(phenylmethyl)pyrrolidin-3-yl]benzenesulfonamide Openeye Name: N-(1-benzylpyrrolidin-3-yl)-5-bromo-N-ethyl-2-methoxy-benzenesulfonamide CAS Name: 5-bromo-N-ethyl-2-methoxy-N-[1-(phenylmethyl)-3-pyrrolidinyl]benzenesulfonamide IUPAC Name: N-(1-benzylpyrrolidin-3-yl)-5-bromo-N-ethyl-2-methoxybenzenesulfonamide Traditional Name: N-(1-benzylpyrrolidin-3-yl)-5-bromo-N-ethyl-2-methoxy-benzenesulfonamide Formula: C20H25BrN2O3S MolecularWeight: 453.3931

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1CCN(C1)CC2=CC=CC=C2)S(=O)(=O)C3=C(C=CC(=C3)Br)OC

Isomeric SMILES

CCN(C1CCN(C1)CC2=CC=CC=C2)S(=O)(=O)C3=C(C=CC(=C3)Br)OC

InChI

InChI=1S/C20H25BrN2O3S/c1-3-23(27(24,25)20-13-17(21)9-10-19(20)26-2)18-11-12-22(15-18)14-16-7-5-4-6-8-16/h4-10,13,18H,3,11-12,14-15H2,1-2H3