5-(azepan-1-ylsulfonyl)-2-(2-methoxyphenyl)-1H-indole-3-carbaldehyde

Systemtic Name: 5-(azepan-1-ylsulfonyl)-2-(2-methoxyphenyl)-1H-indole-3-carbaldehyde Openeye Name: 5-(azepan-1-ylsulfonyl)-2-(2-methoxyphenyl)-1H-indole-3-carbaldehyde CAS Name: 5-(1-azepanylsulfonyl)-2-(2-methoxyphenyl)-1H-indole-3-carboxaldehyde IUPAC Name: 5-(azepan-1-ylsulfonyl)-2-(2-methoxyphenyl)-1H-indole-3-carbaldehyde Traditional Name: 5-(azepan-1-ylsulfonyl)-2-(2-methoxyphenyl)-1H-indole-3-carbaldehyde Formula: C22H24N2O4S MolecularWeight: 412.50196

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2=C(C3=C(N2)C=CC(=C3)S(=O)(=O)N4CCCCCC4)C=O

Isomeric SMILES

COC1=CC=CC=C1C2=C(C3=C(N2)C=CC(=C3)S(=O)(=O)N4CCCCCC4)C=O

InChI

InChI=1S/C22H24N2O4S/c1-28-21-9-5-4-8-17(21)22-19(15-25)18-14-16(10-11-20(18)23-22)29(26,27)24-12-6-2-3-7-13-24/h4-5,8-11,14-15,23H,2-3,6-7,12-13H2,1H3