1-[(E)-3-(4-methoxy-3-oxidanyl-phenyl)prop-2-enoyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[(E)-3-(4-methoxy-3-oxidanyl-phenyl)prop-2-enoyl]piperidine-4-carboxylic acid Openeye Name: 1-[(E)-3-(3-hydroxy-4-methoxy-phenyl)prop-2-enoyl]piperidine-4-carboxylic acid CAS Name: 1-[(E)-3-(3-hydroxy-4-methoxyphenyl)-1-oxoprop-2-enyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[(E)-3-(3-hydroxy-4-methoxyphenyl)prop-2-enoyl]piperidine-4-carboxylic acid Traditional Name: 1-[(E)-3-(3-hydroxy-4-methoxy-phenyl)acryloyl]isonipecotic acid Formula: C16H19NO5 MolecularWeight: 305.32576

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=CC(=O)N2CCC(CC2)C(=O)O)O

Isomeric SMILES

COC1=C(C=C(C=C1)/C=C/C(=O)N2CCC(CC2)C(=O)O)O

InChI

InChI=1S/C16H19NO5/c1-22-14-4-2-11(10-13(14)18)3-5-15(19)17-8-6-12(7-9-17)16(20)21/h2-5,10,12,18H,6-9H2,1H3,(H,20,21)/b5-3+