N-(3-ethylphenyl)-2-[4-[(3-oxidanidyl-1,2-dihydrobenzotriazol-1-ium-1-yl)methyl]phenyl]ethanamide

Systemtic Name: N-(3-ethylphenyl)-2-[4-[(3-oxidanidyl-1,2-dihydrobenzotriazol-1-ium-1-yl)methyl]phenyl]ethanamide Openeye Name: N-(3-ethylphenyl)-2-[4-[(3-oxido-1,2-dihydrobenzotriazol-1-ium-1-yl)methyl]phenyl]acetamide CAS Name: N-(3-ethylphenyl)-2-[4-[(3-oxido-1,2-dihydrobenzotriazol-1-ium-1-yl)methyl]phenyl]acetamide IUPAC Name: N-(3-ethylphenyl)-2-[4-[(3-oxido-1,2-dihydrobenzotriazol-1-ium-1-yl)methyl]phenyl]acetamide Traditional Name: N-(3-ethylphenyl)-2-[4-[(3-oxido-1,2-dihydrobenzotriazol-1-ium-1-yl)methyl]phenyl]acetamide Formula: C23H24N4O2 MolecularWeight: 388.46226

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)NC(=O)CC2=CC=C(C=C2)C[NH+]3C4=CC=CC=C4N(N3)[O-]

Isomeric SMILES

CCC1=CC(=CC=C1)NC(=O)CC2=CC=C(C=C2)C[NH+]3C4=CC=CC=C4N(N3)[O-]

InChI

InChI=1S/C23H23N4O2/c1-2-17-6-5-7-20(14-17)24-23(28)15-18-10-12-19(13-11-18)16-26-21-8-3-4-9-22(21)27(29)25-26/h3-14,25H,2,15-16H2,1H3,(H,24,28)/q-1/p+1