5,8-dimethyl-6-[(3-nitropyridin-2-yl)amino]-2H-isoquinolin-1-one

Systemtic Name: 5,8-dimethyl-6-[(3-nitropyridin-2-yl)amino]-2H-isoquinolin-1-one Openeye Name: 5,8-dimethyl-6-[(3-nitro-2-pyridyl)amino]-2H-isoquinolin-1-one CAS Name: 5,8-dimethyl-6-[(3-nitro-2-pyridinyl)amino]-2H-isoquinolin-1-one IUPAC Name: 5,8-dimethyl-6-[(3-nitropyridin-2-yl)amino]-2H-isoquinolin-1-one Traditional Name: 5,8-dimethyl-6-[(3-nitro-2-pyridyl)amino]isocarbostyril Formula: C16H14N4O3 MolecularWeight: 310.30736

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C2=C1C(=O)NC=C2)C)NC3=C(C=CC=N3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C2=C1C(=O)NC=C2)C)NC3=C(C=CC=N3)[N+](=O)[O-]

InChI

InChI=1S/C16H14N4O3/c1-9-8-12(10(2)11-5-7-18-16(21)14(9)11)19-15-13(20(22)23)4-3-6-17-15/h3-8H,1-2H3,(H,17,19)(H,18,21)