methyl 4-[2-(4-chloranyl-2-methyl-1H-indol-3-yl)ethylsulfonyl]benzoate

Systemtic Name: methyl 4-[2-(4-chloranyl-2-methyl-1H-indol-3-yl)ethylsulfonyl]benzoate Openeye Name: methyl 4-[2-(4-chloro-2-methyl-1H-indol-3-yl)ethylsulfonyl]benzoate CAS Name: 4-[2-(4-chloro-2-methyl-1H-indol-3-yl)ethylsulfonyl]benzoic acid methyl ester IUPAC Name: methyl 4-[2-(4-chloro-2-methyl-1H-indol-3-yl)ethylsulfonyl]benzoate Traditional Name: 4-[2-(4-chloro-2-methyl-1H-indol-3-yl)ethylsulfonyl]benzoic acid methyl ester Formula: C19H18ClNO4S MolecularWeight: 391.86852

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1)C=CC=C2Cl)CCS(=O)(=O)C3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CC1=C(C2=C(N1)C=CC=C2Cl)CCS(=O)(=O)C3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C19H18ClNO4S/c1-12-15(18-16(20)4-3-5-17(18)21-12)10-11-26(23,24)14-8-6-13(7-9-14)19(22)25-2/h3-9,21H,10-11H2,1-2H3