1-ethoxycarbonyloxyethyl 3-piperidin-1-yl-2-[(4-pyridin-4-ylpiperazin-1-yl)carbonylamino]propanoate

Systemtic Name: 1-ethoxycarbonyloxyethyl 3-piperidin-1-yl-2-[(4-pyridin-4-ylpiperazin-1-yl)carbonylamino]propanoate Openeye Name: 1-ethoxycarbonyloxyethyl 3-(1-piperidyl)-2-[[4-(4-pyridyl)piperazine-1-carbonyl]amino]propanoate CAS Name: 2-[[oxo-(4-pyridin-4-yl-1-piperazinyl)methyl]amino]-3-(1-piperidinyl)propanoic acid 1-ethoxycarbonyloxyethyl ester IUPAC Name: 1-ethoxycarbonyloxyethyl 3-piperidin-1-yl-2-[(4-pyridin-4-ylpiperazine-1-carbonyl)amino]propanoate Traditional Name: 3-piperidino-2-[[4-(4-pyridyl)piperazine-1-carbonyl]amino]propionic acid 1-carbethoxyoxyethyl ester Formula: C23H35N5O6 MolecularWeight: 477.5539

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)OC(C)OC(=O)C(CN1CCCCC1)NC(=O)N2CCN(CC2)C3=CC=NC=C3

Isomeric SMILES

CCOC(=O)OC(C)OC(=O)C(CN1CCCCC1)NC(=O)N2CCN(CC2)C3=CC=NC=C3

InChI

InChI=1S/C23H35N5O6/c1-3-32-23(31)34-18(2)33-21(29)20(17-26-11-5-4-6-12-26)25-22(30)28-15-13-27(14-16-28)19-7-9-24-10-8-19/h7-10,18,20H,3-6,11-17H2,1-2H3,(H,25,30)