(E)-3-(1,3-benzodioxol-5-yl)-N-[(4-morpholin-4-ylphenyl)methyl]prop-2-enamide

Systemtic Name: (E)-3-(1,3-benzodioxol-5-yl)-N-[(4-morpholin-4-ylphenyl)methyl]prop-2-enamide Openeye Name: (E)-3-(1,3-benzodioxol-5-yl)-N-[(4-morpholinophenyl)methyl]prop-2-enamide CAS Name: (E)-3-(1,3-benzodioxol-5-yl)-N-[[4-(4-morpholinyl)phenyl]methyl]-2-propenamide IUPAC Name: (E)-3-(1,3-benzodioxol-5-yl)-N-[(4-morpholin-4-ylphenyl)methyl]prop-2-enamide Traditional Name: (E)-3-(1,3-benzodioxol-5-yl)-N-(4-morpholinobenzyl)acrylamide Formula: C21H22N2O4 MolecularWeight: 366.41038

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=CC=C(C=C2)CNC(=O)C=CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1COCCN1C2=CC=C(C=C2)CNC(=O)/C=C/C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C21H22N2O4/c24-21(8-4-16-3-7-19-20(13-16)27-15-26-19)22-14-17-1-5-18(6-2-17)23-9-11-25-12-10-23/h1-8,13H,9-12,14-15H2,(H,22,24)/b8-4+