4-[2-(2,4-dimethoxy-5-pyrrolidin-1-yl-phenyl)prop-2-enoyl]benzenesulfonamide

Systemtic Name: 4-[2-(2,4-dimethoxy-5-pyrrolidin-1-yl-phenyl)prop-2-enoyl]benzenesulfonamide Openeye Name: 4-[2-(2,4-dimethoxy-5-pyrrolidin-1-yl-phenyl)prop-2-enoyl]benzenesulfonamide CAS Name: 4-[2-[2,4-dimethoxy-5-(1-pyrrolidinyl)phenyl]-1-oxoprop-2-enyl]benzenesulfonamide IUPAC Name: 4-[2-(2,4-dimethoxy-5-pyrrolidin-1-ylphenyl)prop-2-enoyl]benzenesulfonamide Traditional Name: 4-[2-(2,4-dimethoxy-5-pyrrolidino-phenyl)acryloyl]benzenesulfonamide Formula: C21H24N2O5S MolecularWeight: 416.49066

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C(=C)C(=O)C2=CC=C(C=C2)S(=O)(=O)N)N3CCCC3)OC

Isomeric SMILES

COC1=CC(=C(C=C1C(=C)C(=O)C2=CC=C(C=C2)S(=O)(=O)N)N3CCCC3)OC

InChI

InChI=1S/C21H24N2O5S/c1-14(21(24)15-6-8-16(9-7-15)29(22,25)26)17-12-18(23-10-4-5-11-23)20(28-3)13-19(17)27-2/h6-9,12-13H,1,4-5,10-11H2,2-3H3,(H2,22,25,26)