3-[(E)-(3-nitrophenyl)methylideneamino]-2-pentyl-quinazolin-4-one

Systemtic Name: 3-[(E)-(3-nitrophenyl)methylideneamino]-2-pentyl-quinazolin-4-one Openeye Name: 3-[(E)-(3-nitrophenyl)methyleneamino]-2-pentyl-quinazolin-4-one CAS Name: 3-[(E)-(3-nitrophenyl)methylideneamino]-2-pentyl-4-quinazolinone IUPAC Name: 3-[(E)-(3-nitrophenyl)methylideneamino]-2-pentylquinazolin-4-one Traditional Name: 2-amyl-3-[(E)-(3-nitrobenzylidene)amino]quinazolin-4-one Formula: C20H20N4O3 MolecularWeight: 364.3978

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=NC2=CC=CC=C2C(=O)N1N=CC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CCCCCC1=NC2=CC=CC=C2C(=O)N1/N=C/C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H20N4O3/c1-2-3-4-12-19-22-18-11-6-5-10-17(18)20(25)23(19)21-14-15-8-7-9-16(13-15)24(26)27/h5-11,13-14H,2-4,12H2,1H3/b21-14+