6-[5-methyl-2-(2-morpholin-4-ium-4-ylethyl)-1H-1,2,4-triazol-3-ylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[5-methyl-2-(2-morpholin-4-ium-4-ylethyl)-1H-1,2,4-triazol-3-ylidene]cyclohexa-2,4-dien-1-one Openeye Name: 6-[5-methyl-2-(2-morpholin-4-ium-4-ylethyl)-1H-1,2,4-triazol-3-ylidene]cyclohexa-2,4-dien-1-one CAS Name: 6-[5-methyl-2-[2-(4-morpholin-4-iumyl)ethyl]-1H-1,2,4-triazol-3-ylidene]-1-cyclohexa-2,4-dienone IUPAC Name: 6-[5-methyl-2-(2-morpholin-4-ium-4-ylethyl)-1H-1,2,4-triazol-3-ylidene]cyclohexa-2,4-dien-1-one Traditional Name: 6-[5-methyl-2-(2-morpholin-4-ium-4-ylethyl)-1H-1,2,4-triazol-3-ylidene]cyclohexa-2,4-dien-1-one Formula: C15H21N4O2+ MolecularWeight: 289.35284

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C2C=CC=CC2=O)N(N1)CC[NH+]3CCOCC3

Isomeric SMILES

CC1=NC(=C2C=CC=CC2=O)N(N1)CC[NH+]3CCOCC3

InChI

InChI=1S/C15H20N4O2/c1-12-16-15(13-4-2-3-5-14(13)20)19(17-12)7-6-18-8-10-21-11-9-18/h2-5H,6-11H2,1H3,(H,16,17)/p+1