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

Systemtic Name: 2-(3-nitro-4-oxidanyl-phenyl)-3-propyl-1,2-dihydroquinazolin-4-one Openeye Name: 2-(4-hydroxy-3-nitro-phenyl)-3-propyl-1,2-dihydroquinazolin-4-one CAS Name: 2-(4-hydroxy-3-nitrophenyl)-3-propyl-1,2-dihydroquinazolin-4-one IUPAC Name: 2-(4-hydroxy-3-nitrophenyl)-3-propyl-1,2-dihydroquinazolin-4-one Traditional Name: 2-(4-hydroxy-3-nitro-phenyl)-3-propyl-1,2-dihydroquinazolin-4-one Formula: C17H17N3O4 MolecularWeight: 327.33458

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(NC2=CC=CC=C2C1=O)C3=CC(=C(C=C3)O)[N+](=O)[O-]

Isomeric SMILES

CCCN1C(NC2=CC=CC=C2C1=O)C3=CC(=C(C=C3)O)[N+](=O)[O-]

InChI

InChI=1S/C17H17N3O4/c1-2-9-19-16(11-7-8-15(21)14(10-11)20(23)24)18-13-6-4-3-5-12(13)17(19)22/h3-8,10,16,18,21H,2,9H2,1H3