[2-(2,5-dimethylthiophen-3-yl)-2-oxidanylidene-ethyl] 2-(benzotriazol-1-yl)ethanoate

Systemtic Name: [2-(2,5-dimethylthiophen-3-yl)-2-oxidanylidene-ethyl] 2-(benzotriazol-1-yl)ethanoate Openeye Name: [2-(2,5-dimethyl-3-thienyl)-2-oxo-ethyl] 2-(benzotriazol-1-yl)acetate CAS Name: 2-(1-benzotriazolyl)acetic acid [2-(2,5-dimethyl-3-thiophenyl)-2-oxoethyl] ester IUPAC Name: [2-(2,5-dimethylthiophen-3-yl)-2-oxoethyl] 2-(benzotriazol-1-yl)acetate Traditional Name: 2-(benzotriazol-1-yl)acetic acid [2-(2,5-dimethyl-3-thienyl)-2-keto-ethyl] ester Formula: C16H15N3O3S MolecularWeight: 329.3736

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)C)C(=O)COC(=O)CN2C3=CC=CC=C3N=N2

Isomeric SMILES

CC1=CC(=C(S1)C)C(=O)COC(=O)CN2C3=CC=CC=C3N=N2

InChI

InChI=1S/C16H15N3O3S/c1-10-7-12(11(2)23-10)15(20)9-22-16(21)8-19-14-6-4-3-5-13(14)17-18-19/h3-7H,8-9H2,1-2H3