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

Systemtic Name: 5-(azepan-1-ylsulfonyl)-2-phenyl-1H-indole-3-carbaldehyde Openeye Name: 5-(azepan-1-ylsulfonyl)-2-phenyl-1H-indole-3-carbaldehyde CAS Name: 5-(1-azepanylsulfonyl)-2-phenyl-1H-indole-3-carboxaldehyde IUPAC Name: 5-(azepan-1-ylsulfonyl)-2-phenyl-1H-indole-3-carbaldehyde Traditional Name: 5-(azepan-1-ylsulfonyl)-2-phenyl-1H-indole-3-carbaldehyde Formula: C21H22N2O3S MolecularWeight: 382.47598

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)NC(=C3C=O)C4=CC=CC=C4

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)NC(=C3C=O)C4=CC=CC=C4

InChI

InChI=1S/C21H22N2O3S/c24-15-19-18-14-17(27(25,26)23-12-6-1-2-7-13-23)10-11-20(18)22-21(19)16-8-4-3-5-9-16/h3-5,8-11,14-15,22H,1-2,6-7,12-13H2