butyl 5-acetyloxy-2-methyl-1-phenyl-indole-3-carboxylate

Systemtic Name: butyl 5-acetyloxy-2-methyl-1-phenyl-indole-3-carboxylate Openeye Name: butyl 5-acetoxy-2-methyl-1-phenyl-indole-3-carboxylate CAS Name: 5-acetyloxy-2-methyl-1-phenyl-3-indolecarboxylic acid butyl ester IUPAC Name: butyl 5-acetyloxy-2-methyl-1-phenylindole-3-carboxylate Traditional Name: 5-acetoxy-2-methyl-1-phenyl-indole-3-carboxylic acid butyl ester Formula: C22H23NO4 MolecularWeight: 365.42232

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H23NO4/c1-4-5-13-26-22(25)21-15(2)23(17-9-7-6-8-10-17)20-12-11-18(14-19(20)21)27-16(3)24/h6-12,14H,4-5,13H2,1-3H3