2-[2-(2-methylphenyl)-4-(2H-1,2,3,4-tetrazol-5-ylmethyl)phenyl]ethanoate

Systemtic Name: 2-[2-(2-methylphenyl)-4-(2H-1,2,3,4-tetrazol-5-ylmethyl)phenyl]ethanoate Openeye Name: 2-[2-(o-tolyl)-4-(2H-tetrazol-5-ylmethyl)phenyl]acetate CAS Name: 2-[2-(2-methylphenyl)-4-(2H-tetrazol-5-ylmethyl)phenyl]acetate IUPAC Name: 2-[2-(2-methylphenyl)-4-(2H-tetrazol-5-ylmethyl)phenyl]acetate Traditional Name: 2-[2-(o-tolyl)-4-(2H-tetrazol-5-ylmethyl)phenyl]acetate Formula: C17H15N4O2- MolecularWeight: 307.3266

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=C(C=CC(=C2)CC3=NNN=N3)CC(=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1C2=C(C=CC(=C2)CC3=NNN=N3)CC(=O)[O-]

InChI

InChI=1S/C17H16N4O2/c1-11-4-2-3-5-14(11)15-8-12(9-16-18-20-21-19-16)6-7-13(15)10-17(22)23/h2-8H,9-10H2,1H3,(H,22,23)(H,18,19,20,21)/p-1