(E)-4-[4-(4-methoxyphenyl)carbonylpiperidin-1-yl]-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (E)-4-[4-(4-methoxyphenyl)carbonylpiperidin-1-yl]-4-oxidanylidene-but-2-enoic acid Openeye Name: (E)-4-[4-(4-methoxybenzoyl)-1-piperidyl]-4-oxo-but-2-enoic acid CAS Name: (E)-4-[4-[(4-methoxyphenyl)-oxomethyl]-1-piperidinyl]-4-oxo-2-butenoic acid IUPAC Name: (E)-4-[4-(4-methoxybenzoyl)piperidin-1-yl]-4-oxobut-2-enoic acid Traditional Name: (E)-4-keto-4-(4-p-anisoylpiperidino)but-2-enoic acid Formula: C17H19NO5 MolecularWeight: 317.33646

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)C2CCN(CC2)C(=O)C=CC(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)C2CCN(CC2)C(=O)/C=C/C(=O)O

InChI

InChI=1S/C17H19NO5/c1-23-14-4-2-12(3-5-14)17(22)13-8-10-18(11-9-13)15(19)6-7-16(20)21/h2-7,13H,8-11H2,1H3,(H,20,21)/b7-6+