ethyl 1,2-dimethyl-5-(4-methylphenyl)carbonyloxy-indole-3-carboxylate

Systemtic Name: ethyl 1,2-dimethyl-5-(4-methylphenyl)carbonyloxy-indole-3-carboxylate Openeye Name: ethyl 1,2-dimethyl-5-(4-methylbenzoyl)oxy-indole-3-carboxylate CAS Name: 1,2-dimethyl-5-[(4-methylphenyl)-oxomethoxy]-3-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 1,2-dimethyl-5-(4-methylbenzoyl)oxyindole-3-carboxylate Traditional Name: 1,2-dimethyl-5-p-toluoyloxy-indole-3-carboxylic acid ethyl ester Formula: C21H21NO4 MolecularWeight: 351.39574

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=C1C=C(C=C2)OC(=O)C3=CC=C(C=C3)C)C)C

Isomeric SMILES

CCOC(=O)C1=C(N(C2=C1C=C(C=C2)OC(=O)C3=CC=C(C=C3)C)C)C

InChI

InChI=1S/C21H21NO4/c1-5-25-21(24)19-14(3)22(4)18-11-10-16(12-17(18)19)26-20(23)15-8-6-13(2)7-9-15/h6-12H,5H2,1-4H3