1-[2-(2-chloranyl-5-oxidanyl-phenyl)prop-2-enoyl]piperidine-3-carboxylic acid

Systemtic Name: 1-[2-(2-chloranyl-5-oxidanyl-phenyl)prop-2-enoyl]piperidine-3-carboxylic acid Openeye Name: 1-[2-(2-chloro-5-hydroxy-phenyl)prop-2-enoyl]piperidine-3-carboxylic acid CAS Name: 1-[2-(2-chloro-5-hydroxyphenyl)-1-oxoprop-2-enyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[2-(2-chloro-5-hydroxyphenyl)prop-2-enoyl]piperidine-3-carboxylic acid Traditional Name: 1-[2-(2-chloro-5-hydroxy-phenyl)acryloyl]nipecotic acid Formula: C15H16ClNO4 MolecularWeight: 309.74484

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Descriptors Computed from Structure

Canonical SMILES:

C=C(C1=C(C=CC(=C1)O)Cl)C(=O)N2CCCC(C2)C(=O)O

Isomeric SMILES

C=C(C1=C(C=CC(=C1)O)Cl)C(=O)N2CCCC(C2)C(=O)O

InChI

InChI=1S/C15H16ClNO4/c1-9(12-7-11(18)4-5-13(12)16)14(19)17-6-2-3-10(8-17)15(20)21/h4-5,7,10,18H,1-3,6,8H2,(H,20,21)