azepan-1-yl-[1-(3-chloranyl-4-ethoxy-phenyl)sulfonylpiperidin-4-yl]methanone

Systemtic Name: azepan-1-yl-[1-(3-chloranyl-4-ethoxy-phenyl)sulfonylpiperidin-4-yl]methanone Openeye Name: azepan-1-yl-[1-(3-chloro-4-ethoxy-phenyl)sulfonyl-4-piperidyl]methanone CAS Name: 1-azepanyl-[1-(3-chloro-4-ethoxyphenyl)sulfonyl-4-piperidinyl]methanone IUPAC Name: azepan-1-yl-[1-(3-chloro-4-ethoxyphenyl)sulfonylpiperidin-4-yl]methanone Traditional Name: azepan-1-yl-[1-(3-chloro-4-ethoxy-phenyl)sulfonyl-4-piperidyl]methanone Formula: C20H29ClN2O4S MolecularWeight: 428.97326

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)N3CCCCCC3)Cl

Isomeric SMILES

CCOC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)N3CCCCCC3)Cl

InChI

InChI=1S/C20H29ClN2O4S/c1-2-27-19-8-7-17(15-18(19)21)28(25,26)23-13-9-16(10-14-23)20(24)22-11-5-3-4-6-12-22/h7-8,15-16H,2-6,9-14H2,1H3