1-[4-[1-(5-chloranyl-2-methoxy-phenyl)sulfonylpiperidin-4-yl]oxyphenyl]-N-methyl-N-(quinolin-6-ylmethyl)methanamine

Systemtic Name: 1-[4-[1-(5-chloranyl-2-methoxy-phenyl)sulfonylpiperidin-4-yl]oxyphenyl]-N-methyl-N-(quinolin-6-ylmethyl)methanamine Openeye Name: 1-[4-[[1-(5-chloro-2-methoxy-phenyl)sulfonyl-4-piperidyl]oxy]phenyl]-N-methyl-N-(6-quinolylmethyl)methanamine CAS Name: 1-[4-[[1-(5-chloro-2-methoxyphenyl)sulfonyl-4-piperidinyl]oxy]phenyl]-N-methyl-N-(6-quinolinylmethyl)methanamine IUPAC Name: 1-[4-[1-(5-chloro-2-methoxyphenyl)sulfonylpiperidin-4-yl]oxyphenyl]-N-methyl-N-(quinolin-6-ylmethyl)methanamine Traditional Name: [4-[[1-(5-chloro-2-methoxy-phenyl)sulfonyl-4-piperidyl]oxy]benzyl]-methyl-(6-quinolylmethyl)amine Formula: C30H32ClN3O4S MolecularWeight: 566.11078

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)OC2CCN(CC2)S(=O)(=O)C3=C(C=CC(=C3)Cl)OC)CC4=CC5=C(C=C4)N=CC=C5

Isomeric SMILES

CN(CC1=CC=C(C=C1)OC2CCN(CC2)S(=O)(=O)C3=C(C=CC(=C3)Cl)OC)CC4=CC5=C(C=C4)N=CC=C5

InChI

InChI=1S/C30H32ClN3O4S/c1-33(21-23-7-11-28-24(18-23)4-3-15-32-28)20-22-5-9-26(10-6-22)38-27-13-16-34(17-14-27)39(35,36)30-19-25(31)8-12-29(30)37-2/h3-12,15,18-19,27H,13-14,16-17,20-21H2,1-2H3