2-[[ethyl-[(2-nitrophenyl)methyl]amino]methyl]-6,7-dimethoxy-1H-quinazolin-4-one

Systemtic Name: 2-[[ethyl-[(2-nitrophenyl)methyl]amino]methyl]-6,7-dimethoxy-1H-quinazolin-4-one Openeye Name: 2-[[ethyl-[(2-nitrophenyl)methyl]amino]methyl]-6,7-dimethoxy-1H-quinazolin-4-one CAS Name: 2-[[ethyl-[(2-nitrophenyl)methyl]amino]methyl]-6,7-dimethoxy-1H-quinazolin-4-one IUPAC Name: 2-[[ethyl-[(2-nitrophenyl)methyl]amino]methyl]-6,7-dimethoxy-1H-quinazolin-4-one Traditional Name: 2-[[ethyl-(2-nitrobenzyl)amino]methyl]-6,7-dimethoxy-1H-quinazolin-4-one Formula: C20H22N4O5 MolecularWeight: 398.41248

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22N4O5/c1-4-23(11-13-7-5-6-8-16(13)24(26)27)12-19-21-15-10-18(29-3)17(28-2)9-14(15)20(25)22-19/h5-10H,4,11-12H2,1-3H3,(H,21,22,25)