(phenylmethyl) 2-(2-methylpropyl)-4,5,6,7-tetrahydroindole-1-carboxylate

Systemtic Name: (phenylmethyl) 2-(2-methylpropyl)-4,5,6,7-tetrahydroindole-1-carboxylate Openeye Name: benzyl 2-isobutyl-4,5,6,7-tetrahydroindole-1-carboxylate CAS Name: 2-(2-methylpropyl)-4,5,6,7-tetrahydroindole-1-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 2-(2-methylpropyl)-4,5,6,7-tetrahydroindole-1-carboxylate Traditional Name: 2-isobutyl-4,5,6,7-tetrahydroindole-1-carboxylic acid benzyl ester Formula: C20H25NO2 MolecularWeight: 311.418

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC2=C(N1C(=O)OCC3=CC=CC=C3)CCCC2

Isomeric SMILES

CC(C)CC1=CC2=C(N1C(=O)OCC3=CC=CC=C3)CCCC2

InChI

InChI=1S/C20H25NO2/c1-15(2)12-18-13-17-10-6-7-11-19(17)21(18)20(22)23-14-16-8-4-3-5-9-16/h3-5,8-9,13,15H,6-7,10-12,14H2,1-2H3