2,3-dihydro-1,4-benzodioxin-3-ylmethyl 2-[4-oxidanyl-3-[(4-piperidin-1-ylpiperidin-1-yl)methyl]phenyl]ethanoate

Systemtic Name: 2,3-dihydro-1,4-benzodioxin-3-ylmethyl 2-[4-oxidanyl-3-[(4-piperidin-1-ylpiperidin-1-yl)methyl]phenyl]ethanoate Openeye Name: 2,3-dihydro-1,4-benzodioxin-3-ylmethyl 2-[4-hydroxy-3-[[4-(1-piperidyl)-1-piperidyl]methyl]phenyl]acetate CAS Name: 2-[4-hydroxy-3-[[4-(1-piperidinyl)-1-piperidinyl]methyl]phenyl]acetic acid 2,3-dihydro-1,4-benzodioxin-3-ylmethyl ester IUPAC Name: 2,3-dihydro-1,4-benzodioxin-3-ylmethyl 2-[4-hydroxy-3-[(4-piperidin-1-ylpiperidin-1-yl)methyl]phenyl]acetate Traditional Name: 2-[4-hydroxy-3-[(4-piperidinopiperidino)methyl]phenyl]acetic acid 2,3-dihydro-1,4-benzodioxin-3-ylmethyl ester Formula: C28H36N2O5 MolecularWeight: 480.59584

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2CCN(CC2)CC3=C(C=CC(=C3)CC(=O)OCC4COC5=CC=CC=C5O4)O

Isomeric SMILES

C1CCN(CC1)C2CCN(CC2)CC3=C(C=CC(=C3)CC(=O)OCC4COC5=CC=CC=C5O4)O

InChI

InChI=1S/C28H36N2O5/c31-25-9-8-21(17-28(32)34-20-24-19-33-26-6-2-3-7-27(26)35-24)16-22(25)18-29-14-10-23(11-15-29)30-12-4-1-5-13-30/h2-3,6-9,16,23-24,31H,1,4-5,10-15,17-20H2