2-(2-ethoxyphenyl)-5-pyrrolidin-1-ylsulfonyl-1H-indole-3-carbaldehyde

Systemtic Name: 2-(2-ethoxyphenyl)-5-pyrrolidin-1-ylsulfonyl-1H-indole-3-carbaldehyde Openeye Name: 2-(2-ethoxyphenyl)-5-pyrrolidin-1-ylsulfonyl-1H-indole-3-carbaldehyde CAS Name: 2-(2-ethoxyphenyl)-5-(1-pyrrolidinylsulfonyl)-1H-indole-3-carboxaldehyde IUPAC Name: 2-(2-ethoxyphenyl)-5-pyrrolidin-1-ylsulfonyl-1H-indole-3-carbaldehyde Traditional Name: 2-o-phenetyl-5-pyrrolidinosulfonyl-1H-indole-3-carbaldehyde Formula: C21H22N2O4S MolecularWeight: 398.47538

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C2=C(C3=C(N2)C=CC(=C3)S(=O)(=O)N4CCCC4)C=O

Isomeric SMILES

CCOC1=CC=CC=C1C2=C(C3=C(N2)C=CC(=C3)S(=O)(=O)N4CCCC4)C=O

InChI

InChI=1S/C21H22N2O4S/c1-2-27-20-8-4-3-7-16(20)21-18(14-24)17-13-15(9-10-19(17)22-21)28(25,26)23-11-5-6-12-23/h3-4,7-10,13-14,22H,2,5-6,11-12H2,1H3