2-(3-chloranyl-4-methoxy-phenyl)-5-piperidin-1-ylsulfonyl-1H-indole-3-carbaldehyde

Systemtic Name: 2-(3-chloranyl-4-methoxy-phenyl)-5-piperidin-1-ylsulfonyl-1H-indole-3-carbaldehyde Openeye Name: 2-(3-chloro-4-methoxy-phenyl)-5-(1-piperidylsulfonyl)-1H-indole-3-carbaldehyde CAS Name: 2-(3-chloro-4-methoxyphenyl)-5-(1-piperidinylsulfonyl)-1H-indole-3-carboxaldehyde IUPAC Name: 2-(3-chloro-4-methoxyphenyl)-5-piperidin-1-ylsulfonyl-1H-indole-3-carbaldehyde Traditional Name: 2-(3-chloro-4-methoxy-phenyl)-5-piperidinosulfonyl-1H-indole-3-carbaldehyde Formula: C21H21ClN2O4S MolecularWeight: 432.92044

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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)N4CCCCC4)C=O)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)C2=C(C3=C(N2)C=CC(=C3)S(=O)(=O)N4CCCCC4)C=O)Cl

InChI

InChI=1S/C21H21ClN2O4S/c1-28-20-8-5-14(11-18(20)22)21-17(13-25)16-12-15(6-7-19(16)23-21)29(26,27)24-9-3-2-4-10-24/h5-8,11-13,23H,2-4,9-10H2,1H3