2-(3-fluoranyl-4-methoxy-phenyl)-5-pyrrolidin-1-ylsulfonyl-1H-indole-3-carbaldehyde

Systemtic Name: 2-(3-fluoranyl-4-methoxy-phenyl)-5-pyrrolidin-1-ylsulfonyl-1H-indole-3-carbaldehyde Openeye Name: 2-(3-fluoro-4-methoxy-phenyl)-5-pyrrolidin-1-ylsulfonyl-1H-indole-3-carbaldehyde CAS Name: 2-(3-fluoro-4-methoxyphenyl)-5-(1-pyrrolidinylsulfonyl)-1H-indole-3-carboxaldehyde IUPAC Name: 2-(3-fluoro-4-methoxyphenyl)-5-pyrrolidin-1-ylsulfonyl-1H-indole-3-carbaldehyde Traditional Name: 2-(3-fluoro-4-methoxy-phenyl)-5-pyrrolidinosulfonyl-1H-indole-3-carbaldehyde Formula: C20H19FN2O4S MolecularWeight: 402.439263

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=C(C3=C(N2)C=CC(=C3)S(=O)(=O)N4CCCC4)C=O)F

Isomeric SMILES

COC1=C(C=C(C=C1)C2=C(C3=C(N2)C=CC(=C3)S(=O)(=O)N4CCCC4)C=O)F

InChI

InChI=1S/C20H19FN2O4S/c1-27-19-7-4-13(10-17(19)21)20-16(12-24)15-11-14(5-6-18(15)22-20)28(25,26)23-8-2-3-9-23/h4-7,10-12,22H,2-3,8-9H2,1H3