2-methyl-3-[(3-nitro-2-oxidanyl-phenyl)methylamino]quinazolin-4-one

Systemtic Name: 2-methyl-3-[(3-nitro-2-oxidanyl-phenyl)methylamino]quinazolin-4-one Openeye Name: 3-[(2-hydroxy-3-nitro-phenyl)methylamino]-2-methyl-quinazolin-4-one CAS Name: 3-[(2-hydroxy-3-nitrophenyl)methylamino]-2-methyl-4-quinazolinone IUPAC Name: 3-[(2-hydroxy-3-nitrophenyl)methylamino]-2-methylquinazolin-4-one Traditional Name: 3-[(2-hydroxy-3-nitro-benzyl)amino]-2-methyl-quinazolin-4-one Formula: C16H14N4O4 MolecularWeight: 326.30676

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=O)N1NCC3=C(C(=CC=C3)[N+](=O)[O-])O

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=O)N1NCC3=C(C(=CC=C3)[N+](=O)[O-])O

InChI

InChI=1S/C16H14N4O4/c1-10-18-13-7-3-2-6-12(13)16(22)19(10)17-9-11-5-4-8-14(15(11)21)20(23)24/h2-8,17,21H,9H2,1H3