4-[[4-chloranyl-2-(3-ethoxy-3-oxidanylidene-propyl)phenyl]amino]piperidine-1-carboxylic acid

Systemtic Name: 4-[[4-chloranyl-2-(3-ethoxy-3-oxidanylidene-propyl)phenyl]amino]piperidine-1-carboxylic acid Openeye Name: 4-[4-chloro-2-(3-ethoxy-3-oxo-propyl)anilino]piperidine-1-carboxylic acid CAS Name: 4-[4-chloro-2-(3-ethoxy-3-oxopropyl)anilino]-1-piperidinecarboxylic acid IUPAC Name: 4-[4-chloro-2-(3-ethoxy-3-oxopropyl)anilino]piperidine-1-carboxylic acid Traditional Name: 4-[4-chloro-2-(3-ethoxy-3-keto-propyl)anilino]piperidine-1-carboxylic acid Formula: C17H23ClN2O4 MolecularWeight: 354.82852

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC1=C(C=CC(=C1)Cl)NC2CCN(CC2)C(=O)O

Isomeric SMILES

CCOC(=O)CCC1=C(C=CC(=C1)Cl)NC2CCN(CC2)C(=O)O

InChI

InChI=1S/C17H23ClN2O4/c1-2-24-16(21)6-3-12-11-13(18)4-5-15(12)19-14-7-9-20(10-8-14)17(22)23/h4-5,11,14,19H,2-3,6-10H2,1H3,(H,22,23)