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

Systemtic Name: methyl 3-piperidin-1-yl-2-[(4-pyridin-4-ylpiperazin-1-yl)carbonylamino]propanoate Openeye Name: methyl 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 methyl ester IUPAC Name: methyl 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 methyl ester Formula: C19H29N5O3 MolecularWeight: 375.46526

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CN1CCCCC1)NC(=O)N2CCN(CC2)C3=CC=NC=C3

Isomeric SMILES

COC(=O)C(CN1CCCCC1)NC(=O)N2CCN(CC2)C3=CC=NC=C3

InChI

InChI=1S/C19H29N5O3/c1-27-18(25)17(15-22-9-3-2-4-10-22)21-19(26)24-13-11-23(12-14-24)16-5-7-20-8-6-16/h5-8,17H,2-4,9-15H2,1H3,(H,21,26)