N-[4-(azepan-1-ylsulfonyl)phenyl]-2,3-bis(chloranyl)-4-methoxy-benzenesulfonamide

Systemtic Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-2,3-bis(chloranyl)-4-methoxy-benzenesulfonamide Openeye Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-2,3-dichloro-4-methoxy-benzenesulfonamide CAS Name: N-[4-(1-azepanylsulfonyl)phenyl]-2,3-dichloro-4-methoxybenzenesulfonamide IUPAC Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-2,3-dichloro-4-methoxybenzenesulfonamide Traditional Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-2,3-dichloro-4-methoxy-benzenesulfonamide Formula: C19H22Cl2N2O5S2 MolecularWeight: 493.42438

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3)Cl)Cl

Isomeric SMILES

COC1=C(C(=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3)Cl)Cl

InChI

InChI=1S/C19H22Cl2N2O5S2/c1-28-16-10-11-17(19(21)18(16)20)29(24,25)22-14-6-8-15(9-7-14)30(26,27)23-12-4-2-3-5-13-23/h6-11,22H,2-5,12-13H2,1H3