2-(2-methoxy-5-methyl-phenyl)-5-piperidin-1-ylsulfonyl-1H-indole-3-carbaldehyde

Systemtic Name: 2-(2-methoxy-5-methyl-phenyl)-5-piperidin-1-ylsulfonyl-1H-indole-3-carbaldehyde Openeye Name: 2-(2-methoxy-5-methyl-phenyl)-5-(1-piperidylsulfonyl)-1H-indole-3-carbaldehyde CAS Name: 2-(2-methoxy-5-methylphenyl)-5-(1-piperidinylsulfonyl)-1H-indole-3-carboxaldehyde IUPAC Name: 2-(2-methoxy-5-methylphenyl)-5-piperidin-1-ylsulfonyl-1H-indole-3-carbaldehyde Traditional Name: 2-(2-methoxy-5-methyl-phenyl)-5-piperidinosulfonyl-1H-indole-3-carbaldehyde Formula: C22H24N2O4S MolecularWeight: 412.50196

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)C2=C(C3=C(N2)C=CC(=C3)S(=O)(=O)N4CCCCC4)C=O

Isomeric SMILES

CC1=CC(=C(C=C1)OC)C2=C(C3=C(N2)C=CC(=C3)S(=O)(=O)N4CCCCC4)C=O

InChI

InChI=1S/C22H24N2O4S/c1-15-6-9-21(28-2)18(12-15)22-19(14-25)17-13-16(7-8-20(17)23-22)29(26,27)24-10-4-3-5-11-24/h6-9,12-14,23H,3-5,10-11H2,1-2H3