N-(1,3-benzodioxol-5-ylmethyl)-3-(4-methoxy-3-morpholin-4-ylsulfonyl-phenyl)prop-2-enamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-3-(4-methoxy-3-morpholin-4-ylsulfonyl-phenyl)prop-2-enamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-3-(4-methoxy-3-morpholinosulfonyl-phenyl)prop-2-enamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-3-[4-methoxy-3-(4-morpholinylsulfonyl)phenyl]-2-propenamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-3-(4-methoxy-3-morpholin-4-ylsulfonylphenyl)prop-2-enamide Traditional Name: 3-(4-methoxy-3-morpholinosulfonyl-phenyl)-N-piperonyl-acrylamide Formula: C22H24N2O7S MolecularWeight: 460.50016

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=CC(=O)NCC2=CC3=C(C=C2)OCO3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

COC1=C(C=C(C=C1)C=CC(=O)NCC2=CC3=C(C=C2)OCO3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C22H24N2O7S/c1-28-19-6-2-16(13-21(19)32(26,27)24-8-10-29-11-9-24)4-7-22(25)23-14-17-3-5-18-20(12-17)31-15-30-18/h2-7,12-13H,8-11,14-15H2,1H3,(H,23,25)