ethyl 4-[1-[2-(1,3-benzodioxol-5-yl)ethanoyl]piperidin-3-yl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[1-[2-(1,3-benzodioxol-5-yl)ethanoyl]piperidin-3-yl]piperazine-1-carboxylate Openeye Name: ethyl 4-[1-[2-(1,3-benzodioxol-5-yl)acetyl]-3-piperidyl]piperazine-1-carboxylate CAS Name: 4-[1-[2-(1,3-benzodioxol-5-yl)-1-oxoethyl]-3-piperidinyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[1-[2-(1,3-benzodioxol-5-yl)acetyl]piperidin-3-yl]piperazine-1-carboxylate Traditional Name: 4-[1-[2-(1,3-benzodioxol-5-yl)acetyl]-3-piperidyl]piperazine-1-carboxylic acid ethyl ester Formula: C21H29N3O5 MolecularWeight: 403.47206

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C2CCCN(C2)C(=O)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C2CCCN(C2)C(=O)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C21H29N3O5/c1-2-27-21(26)23-10-8-22(9-11-23)17-4-3-7-24(14-17)20(25)13-16-5-6-18-19(12-16)29-15-28-18/h5-6,12,17H,2-4,7-11,13-15H2,1H3