N-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-2-methoxy-5-methyl-N-(phenylmethyl)benzenesulfonamide

Systemtic Name: N-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-2-methoxy-5-methyl-N-(phenylmethyl)benzenesulfonamide Openeye Name: N-[2-(azepan-1-yl)-2-oxo-ethyl]-N-benzyl-2-methoxy-5-methyl-benzenesulfonamide CAS Name: N-[2-(1-azepanyl)-2-oxoethyl]-2-methoxy-5-methyl-N-(phenylmethyl)benzenesulfonamide IUPAC Name: N-[2-(azepan-1-yl)-2-oxoethyl]-N-benzyl-2-methoxy-5-methylbenzenesulfonamide Traditional Name: N-[2-(azepan-1-yl)-2-keto-ethyl]-N-benzyl-2-methoxy-5-methyl-benzenesulfonamide Formula: C23H30N2O4S MolecularWeight: 430.5603

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)S(=O)(=O)N(CC2=CC=CC=C2)CC(=O)N3CCCCCC3

Isomeric SMILES

CC1=CC(=C(C=C1)OC)S(=O)(=O)N(CC2=CC=CC=C2)CC(=O)N3CCCCCC3

InChI

InChI=1S/C23H30N2O4S/c1-19-12-13-21(29-2)22(16-19)30(27,28)25(17-20-10-6-5-7-11-20)18-23(26)24-14-8-3-4-9-15-24/h5-7,10-13,16H,3-4,8-9,14-15,17-18H2,1-2H3