1,4-bis[4-[(R)-(2,3-dimethoxyphenyl)-oxidanyl-methyl]piperidin-1-yl]butan-1-one

Systemtic Name: 1,4-bis[4-[(R)-(2,3-dimethoxyphenyl)-oxidanyl-methyl]piperidin-1-yl]butan-1-one Openeye Name: 1,4-bis[4-[(R)-(2,3-dimethoxyphenyl)-hydroxy-methyl]-1-piperidyl]butan-1-one CAS Name: 1,4-bis[4-[(R)-(2,3-dimethoxyphenyl)-hydroxymethyl]-1-piperidinyl]-1-butanone IUPAC Name: 1,4-bis[4-[(R)-(2,3-dimethoxyphenyl)-hydroxymethyl]piperidin-1-yl]butan-1-one Traditional Name: 1,4-bis[4-[(R)-(2,3-dimethoxyphenyl)-hydroxy-methyl]piperidino]butan-1-one Formula: C32H46N2O7 MolecularWeight: 570.71684

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)C(C2CCN(CC2)CCCC(=O)N3CCC(CC3)C(C4=C(C(=CC=C4)OC)OC)O)O

Isomeric SMILES

COC1=CC=CC(=C1OC)[C@@H](C2CCN(CC2)CCCC(=O)N3CCC(CC3)[C@H](C4=C(C(=CC=C4)OC)OC)O)O

InChI

InChI=1S/C32H46N2O7/c1-38-26-10-5-8-24(31(26)40-3)29(36)22-13-18-33(19-14-22)17-7-12-28(35)34-20-15-23(16-21-34)30(37)25-9-6-11-27(39-2)32(25)41-4/h5-6,8-11,22-23,29-30,36-37H,7,12-21H2,1-4H3/t29-,30-/m1/s1