3-[[2-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)-1H-quinazolin-4-yl]amino]propylazanium

Systemtic Name: 3-[[2-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)-1H-quinazolin-4-yl]amino]propylazanium Openeye Name: 3-[[2-(6-oxocyclohexa-2,4-dien-1-ylidene)-1H-quinazolin-4-yl]amino]propylammonium CAS Name: 3-[[2-(6-oxo-1-cyclohexa-2,4-dienylidene)-1H-quinazolin-4-yl]amino]propylammonium IUPAC Name: 3-[[2-(6-oxocyclohexa-2,4-dien-1-ylidene)-1H-quinazolin-4-yl]amino]propylazanium Traditional Name: 3-[[2-(6-ketocyclohexa-2,4-dien-1-ylidene)-1H-quinazolin-4-yl]amino]propylammonium Formula: C17H19N4O+ MolecularWeight: 295.35896

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NC(=C3C=CC=CC3=O)N2)NCCC[NH3+]

Isomeric SMILES

C1=CC=C2C(=C1)C(=NC(=C3C=CC=CC3=O)N2)NCCC[NH3+]

InChI

InChI=1S/C17H18N4O/c18-10-5-11-19-16-12-6-1-3-8-14(12)20-17(21-16)13-7-2-4-9-15(13)22/h1-4,6-9,20H,5,10-11,18H2,(H,19,21)/p+1