tert-butyl-[2-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)-1H-quinazolin-4-ylidene]azanium

Systemtic Name: tert-butyl-[2-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)-1H-quinazolin-4-ylidene]azanium Openeye Name: tert-butyl-[2-(6-oxocyclohexa-2,4-dien-1-ylidene)-1H-quinazolin-4-ylidene]ammonium CAS Name: tert-butyl-[2-(6-oxo-1-cyclohexa-2,4-dienylidene)-1H-quinazolin-4-ylidene]ammonium IUPAC Name: tert-butyl-[2-(6-oxocyclohexa-2,4-dien-1-ylidene)-1H-quinazolin-4-ylidene]azanium Traditional Name: tert-butyl-[2-(6-ketocyclohexa-2,4-dien-1-ylidene)-1H-quinazolin-4-ylidene]ammonium Formula: C18H20N3O+ MolecularWeight: 294.3709

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)[NH+]=C1C2=CC=CC=C2NC(=C3C=CC=CC3=O)N1

Isomeric SMILES

CC(C)(C)[NH+]=C1C2=CC=CC=C2NC(=C3C=CC=CC3=O)N1

InChI

InChI=1S/C18H19N3O/c1-18(2,3)21-17-12-8-4-6-10-14(12)19-16(20-17)13-9-5-7-11-15(13)22/h4-11,19H,1-3H3,(H,20,21)/p+1