(6E)-2-(aminomethyl)-4-butyl-6-(1,2-dihydrobenzotriazol-4-ylidene)cyclohexa-2,4-dien-1-one

Systemtic Name: (6E)-2-(aminomethyl)-4-butyl-6-(1,2-dihydrobenzotriazol-4-ylidene)cyclohexa-2,4-dien-1-one Openeye Name: (6E)-2-(aminomethyl)-4-butyl-6-(1,2-dihydrobenzotriazol-4-ylidene)cyclohexa-2,4-dien-1-one CAS Name: (6E)-2-(aminomethyl)-4-butyl-6-(1,2-dihydrobenzotriazol-4-ylidene)-1-cyclohexa-2,4-dienone IUPAC Name: (6E)-2-(aminomethyl)-4-butyl-6-(1,2-dihydrobenzotriazol-4-ylidene)cyclohexa-2,4-dien-1-one Traditional Name: (6E)-2-(aminomethyl)-4-butyl-6-(1,2-dihydrobenzotriazol-4-ylidene)cyclohexa-2,4-dien-1-one Formula: C17H20N4O MolecularWeight: 296.3669

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=C2C=CC=C3C2=NNN3)C(=O)C(=C1)CN

Isomeric SMILES

CCCCC1=C/C(=C\2/C=CC=C3C2=NNN3)/C(=O)C(=C1)CN

InChI

InChI=1S/C17H20N4O/c1-2-3-5-11-8-12(10-18)17(22)14(9-11)13-6-4-7-15-16(13)20-21-19-15/h4,6-9,19,21H,2-3,5,10,18H2,1H3/b14-13+