2-[1-[(4-nitrophenyl)methyl]-2-oxidanylidene-quinolin-4-yl]ethanenitrile

Systemtic Name: 2-[1-[(4-nitrophenyl)methyl]-2-oxidanylidene-quinolin-4-yl]ethanenitrile Openeye Name: 2-[1-[(4-nitrophenyl)methyl]-2-oxo-4-quinolyl]acetonitrile CAS Name: 2-[1-[(4-nitrophenyl)methyl]-2-oxo-4-quinolinyl]acetonitrile IUPAC Name: 2-[1-[(4-nitrophenyl)methyl]-2-oxoquinolin-4-yl]acetonitrile Traditional Name: 2-[2-keto-1-(4-nitrobenzyl)-4-quinolyl]acetonitrile Formula: C18H13N3O3 MolecularWeight: 319.31412

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC(=O)N2CC3=CC=C(C=C3)[N+](=O)[O-])CC#N

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=O)N2CC3=CC=C(C=C3)[N+](=O)[O-])CC#N

InChI

InChI=1S/C18H13N3O3/c19-10-9-14-11-18(22)20(17-4-2-1-3-16(14)17)12-13-5-7-15(8-6-13)21(23)24/h1-8,11H,9,12H2