N-[4-chloranyl-3-(1-methylpyrrolidin-3-yl)oxy-phenyl]-4-methoxy-2,3,6-trimethyl-benzenesulfonamide

Systemtic Name: N-[4-chloranyl-3-(1-methylpyrrolidin-3-yl)oxy-phenyl]-4-methoxy-2,3,6-trimethyl-benzenesulfonamide Openeye Name: N-[4-chloro-3-(1-methylpyrrolidin-3-yl)oxy-phenyl]-4-methoxy-2,3,6-trimethyl-benzenesulfonamide CAS Name: N-[4-chloro-3-[(1-methyl-3-pyrrolidinyl)oxy]phenyl]-4-methoxy-2,3,6-trimethylbenzenesulfonamide IUPAC Name: N-[4-chloro-3-(1-methylpyrrolidin-3-yl)oxyphenyl]-4-methoxy-2,3,6-trimethylbenzenesulfonamide Traditional Name: N-[4-chloro-3-(1-methylpyrrolidin-3-yl)oxy-phenyl]-4-methoxy-2,3,6-trimethyl-benzenesulfonamide Formula: C21H27ClN2O4S MolecularWeight: 438.96808

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1S(=O)(=O)NC2=CC(=C(C=C2)Cl)OC3CCN(C3)C)C)C)OC

Isomeric SMILES

CC1=CC(=C(C(=C1S(=O)(=O)NC2=CC(=C(C=C2)Cl)OC3CCN(C3)C)C)C)OC

InChI

InChI=1S/C21H27ClN2O4S/c1-13-10-19(27-5)14(2)15(3)21(13)29(25,26)23-16-6-7-18(22)20(11-16)28-17-8-9-24(4)12-17/h6-7,10-11,17,23H,8-9,12H2,1-5H3