2-(3,4-dimethylphenyl)-5-piperidin-1-ylsulfonyl-1H-indole-3-carbaldehyde

Systemtic Name: 2-(3,4-dimethylphenyl)-5-piperidin-1-ylsulfonyl-1H-indole-3-carbaldehyde Openeye Name: 2-(3,4-dimethylphenyl)-5-(1-piperidylsulfonyl)-1H-indole-3-carbaldehyde CAS Name: 2-(3,4-dimethylphenyl)-5-(1-piperidinylsulfonyl)-1H-indole-3-carboxaldehyde IUPAC Name: 2-(3,4-dimethylphenyl)-5-piperidin-1-ylsulfonyl-1H-indole-3-carbaldehyde Traditional Name: 2-(3,4-dimethylphenyl)-5-piperidinosulfonyl-1H-indole-3-carbaldehyde Formula: C22H24N2O3S MolecularWeight: 396.50256

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H24N2O3S/c1-15-6-7-17(12-16(15)2)22-20(14-25)19-13-18(8-9-21(19)23-22)28(26,27)24-10-4-3-5-11-24/h6-9,12-14,23H,3-5,10-11H2,1-2H3