methyl 3-iodanyl-1-methyl-2-(4-methylphenyl)indole-5-carboxylate

Systemtic Name: methyl 3-iodanyl-1-methyl-2-(4-methylphenyl)indole-5-carboxylate Openeye Name: methyl 3-iodo-1-methyl-2-(p-tolyl)indole-5-carboxylate CAS Name: 3-iodo-1-methyl-2-(4-methylphenyl)-5-indolecarboxylic acid methyl ester IUPAC Name: methyl 3-iodo-1-methyl-2-(4-methylphenyl)indole-5-carboxylate Traditional Name: 3-iodo-1-methyl-2-(p-tolyl)indole-5-carboxylic acid methyl ester Formula: C18H16INO2 MolecularWeight: 405.22961

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(C3=C(N2C)C=CC(=C3)C(=O)OC)I

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(C3=C(N2C)C=CC(=C3)C(=O)OC)I

InChI

InChI=1S/C18H16INO2/c1-11-4-6-12(7-5-11)17-16(19)14-10-13(18(21)22-3)8-9-15(14)20(17)2/h4-10H,1-3H3