1-[(7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl]pyridin-1-ium-3-carboxamide

Systemtic Name: 1-[(7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl]pyridin-1-ium-3-carboxamide Openeye Name: 1-[(7-chloro-4-oxo-1H-quinazolin-2-yl)methyl]pyridin-1-ium-3-carboxamide CAS Name: 1-[(7-chloro-4-oxo-1H-quinazolin-2-yl)methyl]-3-pyridin-1-iumcarboxamide IUPAC Name: 1-[(7-chloro-4-oxo-1H-quinazolin-2-yl)methyl]pyridin-1-ium-3-carboxamide Traditional Name: 1-[(7-chloro-4-keto-1H-quinazolin-2-yl)methyl]pyridin-1-ium-3-carboxamide Formula: C15H12ClN4O2+ MolecularWeight: 315.73438

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H11ClN4O2/c16-10-3-4-11-12(6-10)18-13(19-15(11)22)8-20-5-1-2-9(7-20)14(17)21/h1-7H,8H2,(H2-,17,18,19,21,22)/p+1