1-[2-[[4-methoxy-3-(2-oxidanyl-3-pyrrolidin-1-yl-propoxy)phenyl]methylamino]ethyl]piperidin-2-one

Systemtic Name: 1-[2-[[4-methoxy-3-(2-oxidanyl-3-pyrrolidin-1-yl-propoxy)phenyl]methylamino]ethyl]piperidin-2-one Openeye Name: 1-[2-[[3-(2-hydroxy-3-pyrrolidin-1-yl-propoxy)-4-methoxy-phenyl]methylamino]ethyl]piperidin-2-one CAS Name: 1-[2-[[3-[2-hydroxy-3-(1-pyrrolidinyl)propoxy]-4-methoxyphenyl]methylamino]ethyl]-2-piperidinone IUPAC Name: 1-[2-[[3-(2-hydroxy-3-pyrrolidin-1-ylpropoxy)-4-methoxyphenyl]methylamino]ethyl]piperidin-2-one Traditional Name: 1-[2-[[3-(2-hydroxy-3-pyrrolidino-propoxy)-4-methoxy-benzyl]amino]ethyl]-2-piperidone Formula: C22H35N3O4 MolecularWeight: 405.531

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNCCN2CCCCC2=O)OCC(CN3CCCC3)O

Isomeric SMILES

COC1=C(C=C(C=C1)CNCCN2CCCCC2=O)OCC(CN3CCCC3)O

InChI

InChI=1S/C22H35N3O4/c1-28-20-8-7-18(15-23-9-13-25-12-3-2-6-22(25)27)14-21(20)29-17-19(26)16-24-10-4-5-11-24/h7-8,14,19,23,26H,2-6,9-13,15-17H2,1H3