methyl 1-[2-(benzotriazol-1-yl)ethanoyl]-2,3-dihydroindole-5-carboxylate

Systemtic Name: methyl 1-[2-(benzotriazol-1-yl)ethanoyl]-2,3-dihydroindole-5-carboxylate Openeye Name: methyl 1-[2-(benzotriazol-1-yl)acetyl]indoline-5-carboxylate CAS Name: 1-[2-(1-benzotriazolyl)-1-oxoethyl]-2,3-dihydroindole-5-carboxylic acid methyl ester IUPAC Name: methyl 1-[2-(benzotriazol-1-yl)acetyl]-2,3-dihydroindole-5-carboxylate Traditional Name: 1-[2-(benzotriazol-1-yl)acetyl]indoline-5-carboxylic acid methyl ester Formula: C18H16N4O3 MolecularWeight: 336.34464

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)N(CC2)C(=O)CN3C4=CC=CC=C4N=N3

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)N(CC2)C(=O)CN3C4=CC=CC=C4N=N3

InChI

InChI=1S/C18H16N4O3/c1-25-18(24)13-6-7-15-12(10-13)8-9-21(15)17(23)11-22-16-5-3-2-4-14(16)19-20-22/h2-7,10H,8-9,11H2,1H3