(E)-N-(4-pyrrolidin-1-ylsulfonylphenyl)-3-(3,4,5-trimethoxyphenyl)prop-2-enamide

Systemtic Name: (E)-N-(4-pyrrolidin-1-ylsulfonylphenyl)-3-(3,4,5-trimethoxyphenyl)prop-2-enamide Openeye Name: (E)-N-(4-pyrrolidin-1-ylsulfonylphenyl)-3-(3,4,5-trimethoxyphenyl)prop-2-enamide CAS Name: (E)-N-[4-(1-pyrrolidinylsulfonyl)phenyl]-3-(3,4,5-trimethoxyphenyl)-2-propenamide IUPAC Name: (E)-N-(4-pyrrolidin-1-ylsulfonylphenyl)-3-(3,4,5-trimethoxyphenyl)prop-2-enamide Traditional Name: (E)-N-(4-pyrrolidinosulfonylphenyl)-3-(3,4,5-trimethoxyphenyl)acrylamide Formula: C22H26N2O6S MolecularWeight: 446.51664

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C=CC(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCC3

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)/C=C/C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C22H26N2O6S/c1-28-19-14-16(15-20(29-2)22(19)30-3)6-11-21(25)23-17-7-9-18(10-8-17)31(26,27)24-12-4-5-13-24/h6-11,14-15H,4-5,12-13H2,1-3H3,(H,23,25)/b11-6+