2-(3-nitro-4-oxidanyl-phenyl)-3-phenethyl-1,2-dihydroquinazolin-4-one

Systemtic Name: 2-(3-nitro-4-oxidanyl-phenyl)-3-phenethyl-1,2-dihydroquinazolin-4-one Openeye Name: 2-(4-hydroxy-3-nitro-phenyl)-3-phenethyl-1,2-dihydroquinazolin-4-one CAS Name: 2-(4-hydroxy-3-nitrophenyl)-3-phenethyl-1,2-dihydroquinazolin-4-one IUPAC Name: 2-(4-hydroxy-3-nitrophenyl)-3-phenethyl-1,2-dihydroquinazolin-4-one Traditional Name: 2-(4-hydroxy-3-nitro-phenyl)-3-phenethyl-1,2-dihydroquinazolin-4-one Formula: C22H19N3O4 MolecularWeight: 389.40396

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN2C(NC3=CC=CC=C3C2=O)C4=CC(=C(C=C4)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CCN2C(NC3=CC=CC=C3C2=O)C4=CC(=C(C=C4)O)[N+](=O)[O-]

InChI

InChI=1S/C22H19N3O4/c26-20-11-10-16(14-19(20)25(28)29)21-23-18-9-5-4-8-17(18)22(27)24(21)13-12-15-6-2-1-3-7-15/h1-11,14,21,23,26H,12-13H2