2-[2-[[5-chloranyl-4-(2-ethoxy-2-oxidanylidene-ethyl)pyrimidin-2-yl]amino]ethyl]piperidine-1-carboxylic acid

Systemtic Name: 2-[2-[[5-chloranyl-4-(2-ethoxy-2-oxidanylidene-ethyl)pyrimidin-2-yl]amino]ethyl]piperidine-1-carboxylic acid Openeye Name: 2-[2-[[5-chloro-4-(2-ethoxy-2-oxo-ethyl)pyrimidin-2-yl]amino]ethyl]piperidine-1-carboxylic acid CAS Name: 2-[2-[[5-chloro-4-(2-ethoxy-2-oxoethyl)-2-pyrimidinyl]amino]ethyl]-1-piperidinecarboxylic acid IUPAC Name: 2-[2-[[5-chloro-4-(2-ethoxy-2-oxoethyl)pyrimidin-2-yl]amino]ethyl]piperidine-1-carboxylic acid Traditional Name: 2-[2-[[5-chloro-4-(2-ethoxy-2-keto-ethyl)pyrimidin-2-yl]amino]ethyl]piperidine-1-carboxylic acid Formula: C16H23ClN4O4 MolecularWeight: 370.83122

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=NC(=NC=C1Cl)NCCC2CCCCN2C(=O)O

Isomeric SMILES

CCOC(=O)CC1=NC(=NC=C1Cl)NCCC2CCCCN2C(=O)O

InChI

InChI=1S/C16H23ClN4O4/c1-2-25-14(22)9-13-12(17)10-19-15(20-13)18-7-6-11-5-3-4-8-21(11)16(23)24/h10-11H,2-9H2,1H3,(H,23,24)(H,18,19,20)