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

Systemtic Name: (E)-3-phenyl-N-(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)prop-2-enamide Openeye Name: (E)-3-phenyl-N-(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)prop-2-enamide CAS Name: (E)-N-[2-(1-oxopropyl)-3,4-dihydro-1H-isoquinolin-7-yl]-3-phenyl-2-propenamide IUPAC Name: (E)-3-phenyl-N-(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)prop-2-enamide Traditional Name: (E)-3-phenyl-N-(2-propionyl-3,4-dihydro-1H-isoquinolin-7-yl)acrylamide Formula: C21H22N2O2 MolecularWeight: 334.41158

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22N2O2/c1-2-21(25)23-13-12-17-9-10-19(14-18(17)15-23)22-20(24)11-8-16-6-4-3-5-7-16/h3-11,14H,2,12-13,15H2,1H3,(H,22,24)/b11-8+