2-(4-methoxy-3-methyl-phenyl)-5-piperidin-1-ylsulfonyl-1H-indole-3-carbaldehyde

Systemtic Name: 2-(4-methoxy-3-methyl-phenyl)-5-piperidin-1-ylsulfonyl-1H-indole-3-carbaldehyde Openeye Name: 2-(4-methoxy-3-methyl-phenyl)-5-(1-piperidylsulfonyl)-1H-indole-3-carbaldehyde CAS Name: 2-(4-methoxy-3-methylphenyl)-5-(1-piperidinylsulfonyl)-1H-indole-3-carboxaldehyde IUPAC Name: 2-(4-methoxy-3-methylphenyl)-5-piperidin-1-ylsulfonyl-1H-indole-3-carbaldehyde Traditional Name: 2-(4-methoxy-3-methyl-phenyl)-5-piperidinosulfonyl-1H-indole-3-carbaldehyde Formula: C22H24N2O4S MolecularWeight: 412.50196

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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