3-azanyl-2-methyl-7-nitro-4-phenyl-isoquinolin-1-one

Systemtic Name: 3-azanyl-2-methyl-7-nitro-4-phenyl-isoquinolin-1-one Openeye Name: 3-amino-2-methyl-7-nitro-4-phenyl-isoquinolin-1-one CAS Name: 3-amino-2-methyl-7-nitro-4-phenyl-1-isoquinolinone IUPAC Name: 3-amino-2-methyl-7-nitro-4-phenylisoquinolin-1-one Traditional Name: 3-amino-2-methyl-7-nitro-4-phenyl-isocarbostyril Formula: C16H13N3O3 MolecularWeight: 295.29272

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C2=C(C1=O)C=C(C=C2)[N+](=O)[O-])C3=CC=CC=C3)N

Isomeric SMILES

CN1C(=C(C2=C(C1=O)C=C(C=C2)[N+](=O)[O-])C3=CC=CC=C3)N

InChI

InChI=1S/C16H13N3O3/c1-18-15(17)14(10-5-3-2-4-6-10)12-8-7-11(19(21)22)9-13(12)16(18)20/h2-9H,17H2,1H3