benzotriazol-1-yl 3-methyl-1H-indole-6-carboxylate

Systemtic Name: benzotriazol-1-yl 3-methyl-1H-indole-6-carboxylate Openeye Name: benzotriazol-1-yl 3-methyl-1H-indole-6-carboxylate CAS Name: 3-methyl-1H-indole-6-carboxylic acid 1-benzotriazolyl ester IUPAC Name: benzotriazol-1-yl 3-methyl-1H-indole-6-carboxylate Traditional Name: 3-methyl-1H-indole-6-carboxylic acid benzotriazol-1-yl ester Formula: C16H12N4O2 MolecularWeight: 292.29208

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CNC2=C1C=CC(=C2)C(=O)ON3C4=CC=CC=C4N=N3

Isomeric SMILES

CC1=CNC2=C1C=CC(=C2)C(=O)ON3C4=CC=CC=C4N=N3

InChI

InChI=1S/C16H12N4O2/c1-10-9-17-14-8-11(6-7-12(10)14)16(21)22-20-15-5-3-2-4-13(15)18-19-20/h2-9,17H,1H3