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

Systemtic Name: 2-(2-methoxy-5-methyl-phenyl)-5-pyrrolidin-1-ylsulfonyl-1H-indole-3-carbaldehyde Openeye Name: 2-(2-methoxy-5-methyl-phenyl)-5-pyrrolidin-1-ylsulfonyl-1H-indole-3-carbaldehyde CAS Name: 2-(2-methoxy-5-methylphenyl)-5-(1-pyrrolidinylsulfonyl)-1H-indole-3-carboxaldehyde IUPAC Name: 2-(2-methoxy-5-methylphenyl)-5-pyrrolidin-1-ylsulfonyl-1H-indole-3-carbaldehyde Traditional Name: 2-(2-methoxy-5-methyl-phenyl)-5-pyrrolidinosulfonyl-1H-indole-3-carbaldehyde Formula: C21H22N2O4S MolecularWeight: 398.47538

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)C2=C(C3=C(N2)C=CC(=C3)S(=O)(=O)N4CCCC4)C=O

Isomeric SMILES

CC1=CC(=C(C=C1)OC)C2=C(C3=C(N2)C=CC(=C3)S(=O)(=O)N4CCCC4)C=O

InChI

InChI=1S/C21H22N2O4S/c1-14-5-8-20(27-2)17(11-14)21-18(13-24)16-12-15(6-7-19(16)22-21)28(25,26)23-9-3-4-10-23/h5-8,11-13,22H,3-4,9-10H2,1-2H3