(E)-2-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-3-[5-(3-nitrophenyl)furan-2-yl]prop-2-enenitrile

Systemtic Name: (E)-2-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-3-[5-(3-nitrophenyl)furan-2-yl]prop-2-enenitrile Openeye Name: (E)-2-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-3-[5-(3-nitrophenyl)-2-furyl]prop-2-enenitrile CAS Name: (E)-2-[3,4-dihydro-1H-isoquinolin-2-yl(oxo)methyl]-3-[5-(3-nitrophenyl)-2-furanyl]-2-propenenitrile IUPAC Name: (E)-2-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-3-[5-(3-nitrophenyl)furan-2-yl]prop-2-enenitrile Traditional Name: (E)-2-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-3-[5-(3-nitrophenyl)-2-furyl]acrylonitrile Formula: C23H17N3O4 MolecularWeight: 399.39878

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C(=O)C(=CC3=CC=C(O3)C4=CC(=CC=C4)[N+](=O)[O-])C#N

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C(=O)/C(=C/C3=CC=C(O3)C4=CC(=CC=C4)[N+](=O)[O-])/C#N

InChI

InChI=1S/C23H17N3O4/c24-14-19(23(27)25-11-10-16-4-1-2-5-18(16)15-25)13-21-8-9-22(30-21)17-6-3-7-20(12-17)26(28)29/h1-9,12-13H,10-11,15H2/b19-13+