N-[3-[4-[(6R,9aS)-2-(4-chloranyl-3-methoxy-phenyl)-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-6-yl]-2,3-dimethyl-phenoxy]propyl]ethanamide

Systemtic Name: N-[3-[4-[(6R,9aS)-2-(4-chloranyl-3-methoxy-phenyl)-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-6-yl]-2,3-dimethyl-phenoxy]propyl]ethanamide Openeye Name: N-[3-[4-[(6R,9aS)-2-(4-chloro-3-methoxy-phenyl)-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-6-yl]-2,3-dimethyl-phenoxy]propyl]acetamide CAS Name: N-[3-[4-[(6R,9aS)-2-(4-chloro-3-methoxyphenyl)-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-6-yl]-2,3-dimethylphenoxy]propyl]acetamide IUPAC Name: N-[3-[4-[(6R,9aS)-2-(4-chloro-3-methoxyphenyl)-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-6-yl]-2,3-dimethylphenoxy]propyl]acetamide Traditional Name: N-[3-[4-[(6R,9aS)-2-(4-chloro-3-methoxy-phenyl)-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-6-yl]-2,3-dimethyl-phenoxy]propyl]acetamide Formula: C28H38ClN3O3 MolecularWeight: 500.07262

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1C)OCCCNC(=O)C)C2CCCC3N2CCN(C3)C4=CC(=C(C=C4)Cl)OC

Isomeric SMILES

CC1=C(C=CC(=C1C)OCCCNC(=O)C)[C@H]2CCC[C@@H]3N2CCN(C3)C4=CC(=C(C=C4)Cl)OC

InChI

InChI=1S/C28H38ClN3O3/c1-19-20(2)27(35-16-6-13-30-21(3)33)12-10-24(19)26-8-5-7-23-18-31(14-15-32(23)26)22-9-11-25(29)28(17-22)34-4/h9-12,17,23,26H,5-8,13-16,18H2,1-4H3,(H,30,33)/t23-,26+/m0/s1