(E)-3-isoquinolin-5-yl-4-(3-nitrophenyl)but-3-en-2-one

Systemtic Name: (E)-3-isoquinolin-5-yl-4-(3-nitrophenyl)but-3-en-2-one Openeye Name: (E)-3-(5-isoquinolyl)-4-(3-nitrophenyl)but-3-en-2-one CAS Name: (E)-3-(5-isoquinolinyl)-4-(3-nitrophenyl)-3-buten-2-one IUPAC Name: (E)-3-isoquinolin-5-yl-4-(3-nitrophenyl)but-3-en-2-one Traditional Name: (E)-3-(5-isoquinolyl)-4-(3-nitrophenyl)but-3-en-2-one Formula: C19H14N2O3 MolecularWeight: 318.32606

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=CC1=CC(=CC=C1)[N+](=O)[O-])C2=CC=CC3=C2C=CN=C3

Isomeric SMILES

CC(=O)/C(=C/C1=CC(=CC=C1)[N+](=O)[O-])/C2=CC=CC3=C2C=CN=C3

InChI

InChI=1S/C19H14N2O3/c1-13(22)19(11-14-4-2-6-16(10-14)21(23)24)18-7-3-5-15-12-20-9-8-17(15)18/h2-12H,1H3/b19-11-