N-[(2,3-dimethoxyphenyl)methyl]-N-phenethyl-4-pyrrolidin-1-ylsulfonyl-benzenesulfonamide

Systemtic Name: N-[(2,3-dimethoxyphenyl)methyl]-N-phenethyl-4-pyrrolidin-1-ylsulfonyl-benzenesulfonamide Openeye Name: N-[(2,3-dimethoxyphenyl)methyl]-N-phenethyl-4-pyrrolidin-1-ylsulfonyl-benzenesulfonamide CAS Name: N-[(2,3-dimethoxyphenyl)methyl]-N-phenethyl-4-(1-pyrrolidinylsulfonyl)benzenesulfonamide IUPAC Name: N-[(2,3-dimethoxyphenyl)methyl]-N-phenethyl-4-pyrrolidin-1-ylsulfonylbenzenesulfonamide Traditional Name: N-o-veratryl-N-phenethyl-4-pyrrolidinosulfonyl-benzenesulfonamide Formula: C27H32N2O6S2 MolecularWeight: 544.68278

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)CN(CCC2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCC4

Isomeric SMILES

COC1=CC=CC(=C1OC)CN(CCC2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C27H32N2O6S2/c1-34-26-12-8-11-23(27(26)35-2)21-29(20-17-22-9-4-3-5-10-22)37(32,33)25-15-13-24(14-16-25)36(30,31)28-18-6-7-19-28/h3-5,8-16H,6-7,17-21H2,1-2H3