3-[ethanoyl-[4-(4-pyridin-4-ylpiperazin-1-yl)carbonylpiperidin-1-yl]amino]propanoic acid

Systemtic Name: 3-[ethanoyl-[4-(4-pyridin-4-ylpiperazin-1-yl)carbonylpiperidin-1-yl]amino]propanoic acid Openeye Name: 3-[acetyl-[4-[4-(4-pyridyl)piperazine-1-carbonyl]-1-piperidyl]amino]propanoic acid CAS Name: 3-[acetyl-[4-[oxo-(4-pyridin-4-yl-1-piperazinyl)methyl]-1-piperidinyl]amino]propanoic acid IUPAC Name: 3-[acetyl-[4-(4-pyridin-4-ylpiperazine-1-carbonyl)piperidin-1-yl]amino]propanoic acid Traditional Name: 3-[acetyl-[4-[4-(4-pyridyl)piperazine-1-carbonyl]piperidino]amino]propionic acid Formula: C20H29N5O4 MolecularWeight: 403.47536

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(CCC(=O)O)N1CCC(CC1)C(=O)N2CCN(CC2)C3=CC=NC=C3

Isomeric SMILES

CC(=O)N(CCC(=O)O)N1CCC(CC1)C(=O)N2CCN(CC2)C3=CC=NC=C3

InChI

InChI=1S/C20H29N5O4/c1-16(26)25(11-6-19(27)28)24-9-4-17(5-10-24)20(29)23-14-12-22(13-15-23)18-2-7-21-8-3-18/h2-3,7-8,17H,4-6,9-15H2,1H3,(H,27,28)