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

Systemtic Name: 2,3-dihydro-1,4-benzodioxin-3-ylmethyl 2-[4-oxidanyl-3-(4-piperidin-1-ylpiperidin-1-yl)phenyl]ethanoate Openeye Name: 2,3-dihydro-1,4-benzodioxin-3-ylmethyl 2-[4-hydroxy-3-[4-(1-piperidyl)-1-piperidyl]phenyl]acetate CAS Name: 2-[4-hydroxy-3-[4-(1-piperidinyl)-1-piperidinyl]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)phenyl]acetate Traditional Name: 2-[4-hydroxy-3-(4-piperidinopiperidino)phenyl]acetic acid 2,3-dihydro-1,4-benzodioxin-3-ylmethyl ester Formula: C27H34N2O5 MolecularWeight: 466.56926

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H34N2O5/c30-24-9-8-20(16-23(24)29-14-10-21(11-15-29)28-12-4-1-5-13-28)17-27(31)33-19-22-18-32-25-6-2-3-7-26(25)34-22/h2-3,6-9,16,21-22,30H,1,4-5,10-15,17-19H2