3-[[5-(3-methyl-4-nitro-phenyl)-1,2,4-oxadiazol-3-yl]methyl]quinazolin-4-one

Systemtic Name: 3-[[5-(3-methyl-4-nitro-phenyl)-1,2,4-oxadiazol-3-yl]methyl]quinazolin-4-one Openeye Name: 3-[[5-(3-methyl-4-nitro-phenyl)-1,2,4-oxadiazol-3-yl]methyl]quinazolin-4-one CAS Name: 3-[[5-(3-methyl-4-nitrophenyl)-1,2,4-oxadiazol-3-yl]methyl]-4-quinazolinone IUPAC Name: 3-[[5-(3-methyl-4-nitrophenyl)-1,2,4-oxadiazol-3-yl]methyl]quinazolin-4-one Traditional Name: 3-[[5-(3-methyl-4-nitro-phenyl)-1,2,4-oxadiazol-3-yl]methyl]quinazolin-4-one Formula: C18H13N5O4 MolecularWeight: 363.32692

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C2=NC(=NO2)CN3C=NC4=CC=CC=C4C3=O)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C2=NC(=NO2)CN3C=NC4=CC=CC=C4C3=O)[N+](=O)[O-]

InChI

InChI=1S/C18H13N5O4/c1-11-8-12(6-7-15(11)23(25)26)17-20-16(21-27-17)9-22-10-19-14-5-3-2-4-13(14)18(22)24/h2-8,10H,9H2,1H3