[(S)-benzotriazol-1-yl-(4-methylphenyl)methyl] 1H-indole-2-carboxylate

Systemtic Name: [(S)-benzotriazol-1-yl-(4-methylphenyl)methyl] 1H-indole-2-carboxylate Openeye Name: [(S)-benzotriazol-1-yl(p-tolyl)methyl] 1H-indole-2-carboxylate CAS Name: 1H-indole-2-carboxylic acid [(S)-1-benzotriazolyl-(4-methylphenyl)methyl] ester IUPAC Name: [(S)-benzotriazol-1-yl-(4-methylphenyl)methyl] 1H-indole-2-carboxylate Traditional Name: 1H-indole-2-carboxylic acid [(S)-benzotriazol-1-yl(p-tolyl)methyl] ester Formula: C23H18N4O2 MolecularWeight: 382.41462

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(N2C3=CC=CC=C3N=N2)OC(=O)C4=CC5=CC=CC=C5N4

Isomeric SMILES

CC1=CC=C(C=C1)[C@@H](N2C3=CC=CC=C3N=N2)OC(=O)C4=CC5=CC=CC=C5N4

InChI

InChI=1S/C23H18N4O2/c1-15-10-12-16(13-11-15)22(27-21-9-5-4-8-19(21)25-26-27)29-23(28)20-14-17-6-2-3-7-18(17)24-20/h2-14,22,24H,1H3/t22-/m0/s1