2-[[(2-chloranyl-5-nitro-phenyl)methyl-methyl-amino]methyl]-1H-quinazolin-4-one

Systemtic Name: 2-[[(2-chloranyl-5-nitro-phenyl)methyl-methyl-amino]methyl]-1H-quinazolin-4-one Openeye Name: 2-[[(2-chloro-5-nitro-phenyl)methyl-methyl-amino]methyl]-1H-quinazolin-4-one CAS Name: 2-[[(2-chloro-5-nitrophenyl)methyl-methylamino]methyl]-1H-quinazolin-4-one IUPAC Name: 2-[[(2-chloro-5-nitrophenyl)methyl-methylamino]methyl]-1H-quinazolin-4-one Traditional Name: 2-[[(2-chloro-5-nitro-benzyl)-methyl-amino]methyl]-1H-quinazolin-4-one Formula: C17H15ClN4O3 MolecularWeight: 358.779

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=C(C=CC(=C1)[N+](=O)[O-])Cl)CC2=NC(=O)C3=CC=CC=C3N2

Isomeric SMILES

CN(CC1=C(C=CC(=C1)[N+](=O)[O-])Cl)CC2=NC(=O)C3=CC=CC=C3N2

InChI

InChI=1S/C17H15ClN4O3/c1-21(9-11-8-12(22(24)25)6-7-14(11)18)10-16-19-15-5-3-2-4-13(15)17(23)20-16/h2-8H,9-10H2,1H3,(H,19,20,23)