methyl 5-chloranyl-3-(3,4,5-trimethoxyphenyl)sulfonyl-1H-indole-2-carboxylate

Systemtic Name: methyl 5-chloranyl-3-(3,4,5-trimethoxyphenyl)sulfonyl-1H-indole-2-carboxylate Openeye Name: methyl 5-chloro-3-(3,4,5-trimethoxyphenyl)sulfonyl-1H-indole-2-carboxylate CAS Name: 5-chloro-3-(3,4,5-trimethoxyphenyl)sulfonyl-1H-indole-2-carboxylic acid methyl ester IUPAC Name: methyl 5-chloro-3-(3,4,5-trimethoxyphenyl)sulfonyl-1H-indole-2-carboxylate Traditional Name: 5-chloro-3-(3,4,5-trimethoxyphenyl)sulfonyl-1H-indole-2-carboxylic acid methyl ester Formula: C19H18ClNO7S MolecularWeight: 439.86672

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)S(=O)(=O)C2=C(NC3=C2C=C(C=C3)Cl)C(=O)OC

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)S(=O)(=O)C2=C(NC3=C2C=C(C=C3)Cl)C(=O)OC

InChI

InChI=1S/C19H18ClNO7S/c1-25-14-8-11(9-15(26-2)17(14)27-3)29(23,24)18-12-7-10(20)5-6-13(12)21-16(18)19(22)28-4/h5-9,21H,1-4H3