3-[1-(5-chloranyl-2-methoxy-phenyl)sulfonylpiperidin-4-yl]-7-methyl-1H-indole

Systemtic Name: 3-[1-(5-chloranyl-2-methoxy-phenyl)sulfonylpiperidin-4-yl]-7-methyl-1H-indole Openeye Name: 3-[1-(5-chloro-2-methoxy-phenyl)sulfonyl-4-piperidyl]-7-methyl-1H-indole CAS Name: 3-[1-(5-chloro-2-methoxyphenyl)sulfonyl-4-piperidinyl]-7-methyl-1H-indole IUPAC Name: 3-[1-(5-chloro-2-methoxyphenyl)sulfonylpiperidin-4-yl]-7-methyl-1H-indole Traditional Name: 3-[1-(5-chloro-2-methoxy-phenyl)sulfonyl-4-piperidyl]-7-methyl-1H-indole Formula: C21H23ClN2O3S MolecularWeight: 418.93692

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1NC=C2C3CCN(CC3)S(=O)(=O)C4=C(C=CC(=C4)Cl)OC

Isomeric SMILES

CC1=CC=CC2=C1NC=C2C3CCN(CC3)S(=O)(=O)C4=C(C=CC(=C4)Cl)OC

InChI

InChI=1S/C21H23ClN2O3S/c1-14-4-3-5-17-18(13-23-21(14)17)15-8-10-24(11-9-15)28(25,26)20-12-16(22)6-7-19(20)27-2/h3-7,12-13,15,23H,8-11H2,1-2H3