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

Systemtic Name: cyclohexyl 3-[4-[(4-pyridin-4-ylpiperazin-1-yl)carbonylamino]piperidin-1-yl]propanoate Openeye Name: cyclohexyl 3-[4-[[4-(4-pyridyl)piperazine-1-carbonyl]amino]-1-piperidyl]propanoate CAS Name: 3-[4-[[oxo-(4-pyridin-4-yl-1-piperazinyl)methyl]amino]-1-piperidinyl]propanoic acid cyclohexyl ester IUPAC Name: cyclohexyl 3-[4-[(4-pyridin-4-ylpiperazine-1-carbonyl)amino]piperidin-1-yl]propanoate Traditional Name: 3-[4-[[4-(4-pyridyl)piperazine-1-carbonyl]amino]piperidino]propionic acid cyclohexyl ester Formula: C24H37N5O3 MolecularWeight: 443.58228

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)OC(=O)CCN2CCC(CC2)NC(=O)N3CCN(CC3)C4=CC=NC=C4

Isomeric SMILES

C1CCC(CC1)OC(=O)CCN2CCC(CC2)NC(=O)N3CCN(CC3)C4=CC=NC=C4

InChI

InChI=1S/C24H37N5O3/c30-23(32-22-4-2-1-3-5-22)10-15-27-13-8-20(9-14-27)26-24(31)29-18-16-28(17-19-29)21-6-11-25-12-7-21/h6-7,11-12,20,22H,1-5,8-10,13-19H2,(H,26,31)