7-chloranyl-2-[(4-methylpiperidin-1-ium-1-yl)methyl]quinazolin-4-olate

Systemtic Name: 7-chloranyl-2-[(4-methylpiperidin-1-ium-1-yl)methyl]quinazolin-4-olate Openeye Name: 7-chloro-2-[(4-methylpiperidin-1-ium-1-yl)methyl]quinazolin-4-olate CAS Name: 7-chloro-2-[(4-methyl-1-piperidin-1-iumyl)methyl]-4-quinazolinolate IUPAC Name: 7-chloro-2-[(4-methylpiperidin-1-ium-1-yl)methyl]quinazolin-4-olate Traditional Name: 7-chloro-2-[(4-methylpiperidin-1-ium-1-yl)methyl]quinazolin-4-olate Formula: C15H18ClN3O MolecularWeight: 291.77592

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)CC2=NC3=C(C=CC(=C3)Cl)C(=N2)[O-]

Isomeric SMILES

CC1CC[NH+](CC1)CC2=NC3=C(C=CC(=C3)Cl)C(=N2)[O-]

InChI

InChI=1S/C15H18ClN3O/c1-10-4-6-19(7-5-10)9-14-17-13-8-11(16)2-3-12(13)15(20)18-14/h2-3,8,10H,4-7,9H2,1H3,(H,17,18,20)