tert-butyl 3-(phenylmethyl)indole-1-carboxylate

Systemtic Name: tert-butyl 3-(phenylmethyl)indole-1-carboxylate Openeye Name: tert-butyl 3-benzylindole-1-carboxylate CAS Name: 3-(phenylmethyl)-1-indolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-benzylindole-1-carboxylate Traditional Name: 3-benzylindole-1-carboxylic acid tert-butyl ester Formula: C20H21NO2 MolecularWeight: 307.38624

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C=C(C2=CC=CC=C21)CC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)N1C=C(C2=CC=CC=C21)CC3=CC=CC=C3

InChI

InChI=1S/C20H21NO2/c1-20(2,3)23-19(22)21-14-16(13-15-9-5-4-6-10-15)17-11-7-8-12-18(17)21/h4-12,14H,13H2,1-3H3