4-azanyl-1-[3-[5-methoxy-1-[2-(2-methylphenoxy)phenyl]-1-oxidanyl-pentyl]piperidin-1-yl]-3-oxidanyl-butan-1-one

Systemtic Name: 4-azanyl-1-[3-[5-methoxy-1-[2-(2-methylphenoxy)phenyl]-1-oxidanyl-pentyl]piperidin-1-yl]-3-oxidanyl-butan-1-one Openeye Name: 4-amino-3-hydroxy-1-[3-[1-hydroxy-5-methoxy-1-[2-(2-methylphenoxy)phenyl]pentyl]-1-piperidyl]butan-1-one CAS Name: 4-amino-3-hydroxy-1-[3-[1-hydroxy-5-methoxy-1-[2-(2-methylphenoxy)phenyl]pentyl]-1-piperidinyl]-1-butanone IUPAC Name: 4-amino-3-hydroxy-1-[3-[1-hydroxy-5-methoxy-1-[2-(2-methylphenoxy)phenyl]pentyl]piperidin-1-yl]butan-1-one Traditional Name: 4-amino-3-hydroxy-1-[3-[1-hydroxy-5-methoxy-1-[2-(2-methylphenoxy)phenyl]pentyl]piperidino]butan-1-one Formula: C28H40N2O5 MolecularWeight: 484.6276

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OC2=CC=CC=C2C(CCCCOC)(C3CCCN(C3)C(=O)CC(CN)O)O

Isomeric SMILES

CC1=CC=CC=C1OC2=CC=CC=C2C(CCCCOC)(C3CCCN(C3)C(=O)CC(CN)O)O

InChI

InChI=1S/C28H40N2O5/c1-21-10-3-5-13-25(21)35-26-14-6-4-12-24(26)28(33,15-7-8-17-34-2)22-11-9-16-30(20-22)27(32)18-23(31)19-29/h3-6,10,12-14,22-23,31,33H,7-9,11,15-20,29H2,1-2H3