(E)-3-(3,4-dimethoxyphenyl)-N-(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)prop-2-enamide

Systemtic Name: (E)-3-(3,4-dimethoxyphenyl)-N-(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)prop-2-enamide Openeye Name: (E)-3-(3,4-dimethoxyphenyl)-N-(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)prop-2-enamide CAS Name: (E)-3-(3,4-dimethoxyphenyl)-N-[2-(1-oxopropyl)-3,4-dihydro-1H-isoquinolin-7-yl]-2-propenamide IUPAC Name: (E)-3-(3,4-dimethoxyphenyl)-N-(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)prop-2-enamide Traditional Name: (E)-3-(3,4-dimethoxyphenyl)-N-(2-propionyl-3,4-dihydro-1H-isoquinolin-7-yl)acrylamide Formula: C23H26N2O4 MolecularWeight: 394.46354

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCC2=C(C1)C=C(C=C2)NC(=O)C=CC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CCC(=O)N1CCC2=C(C1)C=C(C=C2)NC(=O)/C=C/C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C23H26N2O4/c1-4-23(27)25-12-11-17-7-8-19(14-18(17)15-25)24-22(26)10-6-16-5-9-20(28-2)21(13-16)29-3/h5-10,13-14H,4,11-12,15H2,1-3H3,(H,24,26)/b10-6+