N-[2-[4-(azepan-1-yl)phenyl]ethyl]-5-chloranyl-2-methoxy-benzenesulfonamide

Systemtic Name: N-[2-[4-(azepan-1-yl)phenyl]ethyl]-5-chloranyl-2-methoxy-benzenesulfonamide Openeye Name: N-[2-[4-(azepan-1-yl)phenyl]ethyl]-5-chloro-2-methoxy-benzenesulfonamide CAS Name: N-[2-[4-(1-azepanyl)phenyl]ethyl]-5-chloro-2-methoxybenzenesulfonamide IUPAC Name: N-[2-[4-(azepan-1-yl)phenyl]ethyl]-5-chloro-2-methoxybenzenesulfonamide Traditional Name: N-[2-[4-(azepan-1-yl)phenyl]ethyl]-5-chloro-2-methoxy-benzenesulfonamide Formula: C21H27ClN2O3S MolecularWeight: 422.96868

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)S(=O)(=O)NCCC2=CC=C(C=C2)N3CCCCCC3

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)S(=O)(=O)NCCC2=CC=C(C=C2)N3CCCCCC3

InChI

InChI=1S/C21H27ClN2O3S/c1-27-20-11-8-18(22)16-21(20)28(25,26)23-13-12-17-6-9-19(10-7-17)24-14-4-2-3-5-15-24/h6-11,16,23H,2-5,12-15H2,1H3