4-methoxy-2,3,6-trimethyl-N-[1-(phenylmethyl)pyrrolidin-3-yl]benzenesulfonamide

Systemtic Name: 4-methoxy-2,3,6-trimethyl-N-[1-(phenylmethyl)pyrrolidin-3-yl]benzenesulfonamide Openeye Name: N-(1-benzylpyrrolidin-3-yl)-4-methoxy-2,3,6-trimethyl-benzenesulfonamide CAS Name: 4-methoxy-2,3,6-trimethyl-N-[1-(phenylmethyl)-3-pyrrolidinyl]benzenesulfonamide IUPAC Name: N-(1-benzylpyrrolidin-3-yl)-4-methoxy-2,3,6-trimethylbenzenesulfonamide Traditional Name: N-(1-benzylpyrrolidin-3-yl)-4-methoxy-2,3,6-trimethyl-benzenesulfonamide Formula: C21H28N2O3S MolecularWeight: 388.52362

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1S(=O)(=O)NC2CCN(C2)CC3=CC=CC=C3)C)C)OC

Isomeric SMILES

CC1=CC(=C(C(=C1S(=O)(=O)NC2CCN(C2)CC3=CC=CC=C3)C)C)OC

InChI

InChI=1S/C21H28N2O3S/c1-15-12-20(26-4)16(2)17(3)21(15)27(24,25)22-19-10-11-23(14-19)13-18-8-6-5-7-9-18/h5-9,12,19,22H,10-11,13-14H2,1-4H3