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

Systemtic Name: (E)-N-(2-ethanoyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-(4-nitrophenyl)prop-2-enamide Openeye Name: (E)-N-(2-acetyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-(4-nitrophenyl)prop-2-enamide CAS Name: (E)-N-(2-acetyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-(4-nitrophenyl)-2-propenamide IUPAC Name: (E)-N-(2-acetyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-(4-nitrophenyl)prop-2-enamide Traditional Name: (E)-N-(2-acetyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-(4-nitrophenyl)acrylamide Formula: C20H19N3O4 MolecularWeight: 365.38256

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCC2=C(C1)C=C(C=C2)NC(=O)C=CC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(=O)N1CCC2=C(C1)C=C(C=C2)NC(=O)/C=C/C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H19N3O4/c1-14(24)22-11-10-16-5-6-18(12-17(16)13-22)21-20(25)9-4-15-2-7-19(8-3-15)23(26)27/h2-9,12H,10-11,13H2,1H3,(H,21,25)/b9-4+