1-(3-morpholin-4-ium-4-ylpropyl)chromeno[3,4-d][1,2,3]triazol-4-one

Systemtic Name: 1-(3-morpholin-4-ium-4-ylpropyl)chromeno[3,4-d][1,2,3]triazol-4-one Openeye Name: 1-(3-morpholin-4-ium-4-ylpropyl)chromeno[3,4-d]triazol-4-one CAS Name: 1-[3-(4-morpholin-4-iumyl)propyl]-4-[1]benzopyrano[3,4-d]triazolone IUPAC Name: 1-(3-morpholin-4-ium-4-ylpropyl)chromeno[3,4-d]triazol-4-one Traditional Name: 1-(3-morpholin-4-ium-4-ylpropyl)chromeno[3,4-d]triazol-4-one Formula: C16H19N4O3+ MolecularWeight: 315.34706

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCCN2C3=C(C(=O)OC4=CC=CC=C43)N=N2

Isomeric SMILES

C1COCC[NH+]1CCCN2C3=C(C(=O)OC4=CC=CC=C43)N=N2

InChI

InChI=1S/C16H18N4O3/c21-16-14-15(12-4-1-2-5-13(12)23-16)20(18-17-14)7-3-6-19-8-10-22-11-9-19/h1-2,4-5H,3,6-11H2/p+1