methyl 3-cyclohexyl-2-[(4-pyridin-4-ylpiperazin-1-yl)carbonylamino]propanoate

Systemtic Name: methyl 3-cyclohexyl-2-[(4-pyridin-4-ylpiperazin-1-yl)carbonylamino]propanoate Openeye Name: methyl 3-cyclohexyl-2-[[4-(4-pyridyl)piperazine-1-carbonyl]amino]propanoate CAS Name: 3-cyclohexyl-2-[[oxo-(4-pyridin-4-yl-1-piperazinyl)methyl]amino]propanoic acid methyl ester IUPAC Name: methyl 3-cyclohexyl-2-[(4-pyridin-4-ylpiperazine-1-carbonyl)amino]propanoate Traditional Name: 3-cyclohexyl-2-[[4-(4-pyridyl)piperazine-1-carbonyl]amino]propionic acid methyl ester Formula: C20H30N4O3 MolecularWeight: 374.4772

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1CCCCC1)NC(=O)N2CCN(CC2)C3=CC=NC=C3

Isomeric SMILES

COC(=O)C(CC1CCCCC1)NC(=O)N2CCN(CC2)C3=CC=NC=C3

InChI

InChI=1S/C20H30N4O3/c1-27-19(25)18(15-16-5-3-2-4-6-16)22-20(26)24-13-11-23(12-14-24)17-7-9-21-10-8-17/h7-10,16,18H,2-6,11-15H2,1H3,(H,22,26)