3-[(1-methylpiperidin-1-ium-4-ylidene)amino]quinazolin-4-one

Systemtic Name: 3-[(1-methylpiperidin-1-ium-4-ylidene)amino]quinazolin-4-one Openeye Name: 3-[(1-methylpiperidin-1-ium-4-ylidene)amino]quinazolin-4-one CAS Name: 3-[(1-methyl-4-piperidin-1-iumylidene)amino]-4-quinazolinone IUPAC Name: 3-[(1-methylpiperidin-1-ium-4-ylidene)amino]quinazolin-4-one Traditional Name: 3-[(1-methylpiperidin-1-ium-4-ylidene)amino]quinazolin-4-one Formula: C14H17N4O+ MolecularWeight: 257.31098

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(=NN2C=NC3=CC=CC=C3C2=O)CC1

Isomeric SMILES

C[NH+]1CCC(=NN2C=NC3=CC=CC=C3C2=O)CC1

InChI

InChI=1S/C14H16N4O/c1-17-8-6-11(7-9-17)16-18-10-15-13-5-3-2-4-12(13)14(18)19/h2-5,10H,6-9H2,1H3/p+1