[2-[(2-methyl-4-oxidanylidene-4aH-quinazolin-3-ium-3-yl)iminomethyl]phenyl] 3,4,5-trimethoxybenzoate

Systemtic Name: [2-[(2-methyl-4-oxidanylidene-4aH-quinazolin-3-ium-3-yl)iminomethyl]phenyl] 3,4,5-trimethoxybenzoate Openeye Name: [2-[(2-methyl-4-oxo-4aH-quinazolin-3-ium-3-yl)iminomethyl]phenyl] 3,4,5-trimethoxybenzoate CAS Name: 3,4,5-trimethoxybenzoic acid [2-[(2-methyl-4-oxo-4aH-quinazolin-3-ium-3-yl)iminomethyl]phenyl] ester IUPAC Name: [2-[(2-methyl-4-oxo-4aH-quinazolin-3-ium-3-yl)iminomethyl]phenyl] 3,4,5-trimethoxybenzoate Traditional Name: 3,4,5-trimethoxybenzoic acid [2-[(4-keto-2-methyl-4aH-quinazolin-3-ium-3-yl)iminomethyl]phenyl] ester Formula: C26H24N3O6+ MolecularWeight: 474.48526

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C(=O)C2C=CC=CC2=N1)N=CC3=CC=CC=C3OC(=O)C4=CC(=C(C(=C4)OC)OC)OC

Isomeric SMILES

CC1=[N+](C(=O)C2C=CC=CC2=N1)N=CC3=CC=CC=C3OC(=O)C4=CC(=C(C(=C4)OC)OC)OC

InChI

InChI=1S/C26H24N3O6/c1-16-28-20-11-7-6-10-19(20)25(30)29(16)27-15-17-9-5-8-12-21(17)35-26(31)18-13-22(32-2)24(34-4)23(14-18)33-3/h5-15,19H,1-4H3/q+1