N-[2-methoxy-5-[6-(phenethylamino)hexanoyl]phenyl]methanesulfonamide hydrochloride

Systemtic Name: N-[2-methoxy-5-[6-(phenethylamino)hexanoyl]phenyl]methanesulfonamide hydrochloride Openeye Name: N-[2-methoxy-5-[6-(phenethylamino)hexanoyl]phenyl]methanesulfonamide hydrochloride CAS Name: N-[2-methoxy-5-[1-oxo-6-(phenethylamino)hexyl]phenyl]methanesulfonamide hydrochloride IUPAC Name: N-[2-methoxy-5-[6-(phenethylamino)hexanoyl]phenyl]methanesulfonamide hydrochloride Traditional Name: N-[2-methoxy-5-[6-(phenethylamino)hexanoyl]phenyl]methanesulfonamide hydrochloride Formula: C22H31ClN2O4S MolecularWeight: 455.01054

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)CCCCCNCCC2=CC=CC=C2)NS(=O)(=O)C.Cl

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)CCCCCNCCC2=CC=CC=C2)NS(=O)(=O)C.Cl

InChI

InChI=1S/C22H30N2O4S.ClH/c1-28-22-13-12-19(17-20(22)24-29(2,26)27)21(25)11-7-4-8-15-23-16-14-18-9-5-3-6-10-18;/h3,5-6,9-10,12-13,17,23-24H,4,7-8,11,14-16H2,1-2H3;1H