tert-butyl 4-methanoyl-3-(phenylmethyl)indole-1-carboxylate

Systemtic Name: tert-butyl 4-methanoyl-3-(phenylmethyl)indole-1-carboxylate Openeye Name: tert-butyl 3-benzyl-4-formyl-indole-1-carboxylate CAS Name: 4-formyl-3-(phenylmethyl)-1-indolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-benzyl-4-formylindole-1-carboxylate Traditional Name: 3-benzyl-4-formyl-indole-1-carboxylic acid tert-butyl ester Formula: C21H21NO3 MolecularWeight: 335.39634

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H21NO3/c1-21(2,3)25-20(24)22-13-17(12-15-8-5-4-6-9-15)19-16(14-23)10-7-11-18(19)22/h4-11,13-14H,12H2,1-3H3