dimethyl 5-[6-[(E)-3-oxidanylundec-1-enyl]pyridin-2-yl]carbonylbenzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[6-[(E)-3-oxidanylundec-1-enyl]pyridin-2-yl]carbonylbenzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[6-[(E)-3-hydroxyundec-1-enyl]pyridine-2-carbonyl]benzene-1,3-dicarboxylate CAS Name: 5-[[6-[(E)-3-hydroxyundec-1-enyl]-2-pyridinyl]-oxomethyl]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[6-[(E)-3-hydroxyundec-1-enyl]pyridine-2-carbonyl]benzene-1,3-dicarboxylate Traditional Name: 5-[6-[(E)-3-hydroxyundec-1-enyl]picolinoyl]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C27H33NO6 MolecularWeight: 467.55402

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(C=CC1=NC(=CC=C1)C(=O)C2=CC(=CC(=C2)C(=O)OC)C(=O)OC)O

Isomeric SMILES

CCCCCCCCC(/C=C/C1=NC(=CC=C1)C(=O)C2=CC(=CC(=C2)C(=O)OC)C(=O)OC)O

InChI

InChI=1S/C27H33NO6/c1-4-5-6-7-8-9-12-23(29)15-14-22-11-10-13-24(28-22)25(30)19-16-20(26(31)33-2)18-21(17-19)27(32)34-3/h10-11,13-18,23,29H,4-9,12H2,1-3H3/b15-14+