tert-butyl 2-(4,6,6-trimethylcyclohexa-1,3-dien-1-yl)carbonylindole-1-carboxylate

Systemtic Name: tert-butyl 2-(4,6,6-trimethylcyclohexa-1,3-dien-1-yl)carbonylindole-1-carboxylate Openeye Name: tert-butyl 2-(4,6,6-trimethylcyclohexa-1,3-diene-1-carbonyl)indole-1-carboxylate CAS Name: 2-[oxo-(4,6,6-trimethyl-1-cyclohexa-1,3-dienyl)methyl]-1-indolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-(4,6,6-trimethylcyclohexa-1,3-diene-1-carbonyl)indole-1-carboxylate Traditional Name: 2-(4,6,6-trimethylcyclohexa-1,3-diene-1-carbonyl)indole-1-carboxylic acid tert-butyl ester Formula: C23H27NO3 MolecularWeight: 365.46538

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C(C1)(C)C)C(=O)C2=CC3=CC=CC=C3N2C(=O)OC(C)(C)C

Isomeric SMILES

CC1=CC=C(C(C1)(C)C)C(=O)C2=CC3=CC=CC=C3N2C(=O)OC(C)(C)C

InChI

InChI=1S/C23H27NO3/c1-15-11-12-17(23(5,6)14-15)20(25)19-13-16-9-7-8-10-18(16)24(19)21(26)27-22(2,3)4/h7-13H,14H2,1-6H3