2-[methyl-[4-[(4-pyridin-4-ylpiperazin-1-yl)carbonylamino]cyclohexyl]amino]ethanoic acid

Systemtic Name: 2-[methyl-[4-[(4-pyridin-4-ylpiperazin-1-yl)carbonylamino]cyclohexyl]amino]ethanoic acid Openeye Name: 2-[methyl-[4-[[4-(4-pyridyl)piperazine-1-carbonyl]amino]cyclohexyl]amino]acetic acid CAS Name: 2-[methyl-[4-[[oxo-(4-pyridin-4-yl-1-piperazinyl)methyl]amino]cyclohexyl]amino]acetic acid IUPAC Name: 2-[methyl-[4-[(4-pyridin-4-ylpiperazine-1-carbonyl)amino]cyclohexyl]amino]acetic acid Traditional Name: 2-[methyl-[4-[[4-(4-pyridyl)piperazine-1-carbonyl]amino]cyclohexyl]amino]acetic acid Formula: C19H29N5O3 MolecularWeight: 375.46526

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)O)C1CCC(CC1)NC(=O)N2CCN(CC2)C3=CC=NC=C3

Isomeric SMILES

CN(CC(=O)O)C1CCC(CC1)NC(=O)N2CCN(CC2)C3=CC=NC=C3

InChI

InChI=1S/C19H29N5O3/c1-22(14-18(25)26)16-4-2-15(3-5-16)21-19(27)24-12-10-23(11-13-24)17-6-8-20-9-7-17/h6-9,15-16H,2-5,10-14H2,1H3,(H,21,27)(H,25,26)