(E)-2-methyl-4-oxidanylidene-3-[3-(3,4,5-trimethoxyphenyl)piperidin-4-yl]oct-5-en-7-ynoic acid

Systemtic Name: (E)-2-methyl-4-oxidanylidene-3-[3-(3,4,5-trimethoxyphenyl)piperidin-4-yl]oct-5-en-7-ynoic acid Openeye Name: (E)-2-methyl-4-oxo-3-[3-(3,4,5-trimethoxyphenyl)-4-piperidyl]oct-5-en-7-ynoic acid CAS Name: (E)-2-methyl-4-oxo-3-[3-(3,4,5-trimethoxyphenyl)-4-piperidinyl]oct-5-en-7-ynoic acid IUPAC Name: (E)-2-methyl-4-oxo-3-[3-(3,4,5-trimethoxyphenyl)piperidin-4-yl]oct-5-en-7-ynoic acid Traditional Name: (E)-4-keto-2-methyl-3-[3-(3,4,5-trimethoxyphenyl)-4-piperidyl]oct-5-en-7-ynoic acid Formula: C23H29NO6 MolecularWeight: 415.47946

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C1CCNCC1C2=CC(=C(C(=C2)OC)OC)OC)C(=O)C=CC#C)C(=O)O

Isomeric SMILES

CC(C(C1CCNCC1C2=CC(=C(C(=C2)OC)OC)OC)C(=O)/C=C/C#C)C(=O)O

InChI

InChI=1S/C23H29NO6/c1-6-7-8-18(25)21(14(2)23(26)27)16-9-10-24-13-17(16)15-11-19(28-3)22(30-5)20(12-15)29-4/h1,7-8,11-12,14,16-17,21,24H,9-10,13H2,2-5H3,(H,26,27)/b8-7+