N-cyclopropyl-4-[2-(4-methoxyphenyl)azepan-1-yl]carbonyl-benzenesulfonamide

Systemtic Name: N-cyclopropyl-4-[2-(4-methoxyphenyl)azepan-1-yl]carbonyl-benzenesulfonamide Openeye Name: N-cyclopropyl-4-[2-(4-methoxyphenyl)azepane-1-carbonyl]benzenesulfonamide CAS Name: N-cyclopropyl-4-[[2-(4-methoxyphenyl)-1-azepanyl]-oxomethyl]benzenesulfonamide IUPAC Name: N-cyclopropyl-4-[2-(4-methoxyphenyl)azepane-1-carbonyl]benzenesulfonamide Traditional Name: N-cyclopropyl-4-[2-(4-methoxyphenyl)azepane-1-carbonyl]benzenesulfonamide Formula: C23H28N2O4S MolecularWeight: 428.54442

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2CCCCCN2C(=O)C3=CC=C(C=C3)S(=O)(=O)NC4CC4

Isomeric SMILES

COC1=CC=C(C=C1)C2CCCCCN2C(=O)C3=CC=C(C=C3)S(=O)(=O)NC4CC4

InChI

InChI=1S/C23H28N2O4S/c1-29-20-12-6-17(7-13-20)22-5-3-2-4-16-25(22)23(26)18-8-14-21(15-9-18)30(27,28)24-19-10-11-19/h6-9,12-15,19,22,24H,2-5,10-11,16H2,1H3