2-ethyl-3-[(E)-[4-[(4-nitrophenyl)methoxy]phenyl]methylideneamino]-4aH-quinazolin-3-ium-4-one

Systemtic Name: 2-ethyl-3-[(E)-[4-[(4-nitrophenyl)methoxy]phenyl]methylideneamino]-4aH-quinazolin-3-ium-4-one Openeye Name: 2-ethyl-3-[(E)-[4-[(4-nitrophenyl)methoxy]phenyl]methyleneamino]-4aH-quinazolin-3-ium-4-one CAS Name: 2-ethyl-3-[(E)-[4-[(4-nitrophenyl)methoxy]phenyl]methylideneamino]-4aH-quinazolin-3-ium-4-one IUPAC Name: 2-ethyl-3-[(E)-[4-[(4-nitrophenyl)methoxy]phenyl]methylideneamino]-4aH-quinazolin-3-ium-4-one Traditional Name: 2-ethyl-3-[(E)-[4-(4-nitrobenzyl)oxybenzylidene]amino]-4aH-quinazolin-3-ium-4-one Formula: C24H21N4O4+ MolecularWeight: 429.44794

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=[N+](C(=O)C2C=CC=CC2=N1)N=CC3=CC=C(C=C3)OCC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CCC1=[N+](C(=O)C2C=CC=CC2=N1)/N=C/C3=CC=C(C=C3)OCC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C24H21N4O4/c1-2-23-26-22-6-4-3-5-21(22)24(29)27(23)25-15-17-9-13-20(14-10-17)32-16-18-7-11-19(12-8-18)28(30)31/h3-15,21H,2,16H2,1H3/q+1/b25-15+