1-cyclohexylpropyl 1-(benzotriazol-1-yl)-3-methyl-indole-6-carboxylate

Systemtic Name: 1-cyclohexylpropyl 1-(benzotriazol-1-yl)-3-methyl-indole-6-carboxylate Openeye Name: 1-cyclohexylpropyl 1-(benzotriazol-1-yl)-3-methyl-indole-6-carboxylate CAS Name: 1-(1-benzotriazolyl)-3-methyl-6-indolecarboxylic acid 1-cyclohexylpropyl ester IUPAC Name: 1-cyclohexylpropyl 1-(benzotriazol-1-yl)-3-methylindole-6-carboxylate Traditional Name: 1-(benzotriazol-1-yl)-3-methyl-indole-6-carboxylic acid 1-cyclohexylpropyl ester Formula: C25H28N4O2 MolecularWeight: 416.51542

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1CCCCC1)OC(=O)C2=CC3=C(C=C2)C(=CN3N4C5=CC=CC=C5N=N4)C

Isomeric SMILES

CCC(C1CCCCC1)OC(=O)C2=CC3=C(C=C2)C(=CN3N4C5=CC=CC=C5N=N4)C

InChI

InChI=1S/C25H28N4O2/c1-3-24(18-9-5-4-6-10-18)31-25(30)19-13-14-20-17(2)16-28(23(20)15-19)29-22-12-8-7-11-21(22)26-27-29/h7-8,11-16,18,24H,3-6,9-10H2,1-2H3