(7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl-methyl-(phenylmethyl)azanium

Systemtic Name: (7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl-methyl-(phenylmethyl)azanium Openeye Name: benzyl-[(7-chloro-4-oxo-1H-quinazolin-2-yl)methyl]-methyl-ammonium CAS Name: (7-chloro-4-oxo-1H-quinazolin-2-yl)methyl-methyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[(7-chloro-4-oxo-1H-quinazolin-2-yl)methyl]-methylazanium Traditional Name: benzyl-[(7-chloro-4-keto-1H-quinazolin-2-yl)methyl]-methyl-ammonium Formula: C17H17ClN3O+ MolecularWeight: 314.78938

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=CC=C1)CC2=NC(=O)C3=C(N2)C=C(C=C3)Cl

Isomeric SMILES

C[NH+](CC1=CC=CC=C1)CC2=NC(=O)C3=C(N2)C=C(C=C3)Cl

InChI

InChI=1S/C17H16ClN3O/c1-21(10-12-5-3-2-4-6-12)11-16-19-15-9-13(18)7-8-14(15)17(22)20-16/h2-9H,10-11H2,1H3,(H,19,20,22)/p+1