5-(4-decoxydecoxy)-4-(4-oxidanylidene-3-phenyl-chromen-7-yl)pyridine-3-carboxylic acid

Systemtic Name: 5-(4-decoxydecoxy)-4-(4-oxidanylidene-3-phenyl-chromen-7-yl)pyridine-3-carboxylic acid Openeye Name: 5-(4-decoxydecoxy)-4-(4-oxo-3-phenyl-chromen-7-yl)pyridine-3-carboxylic acid CAS Name: 5-(4-decoxydecoxy)-4-(4-oxo-3-phenyl-1-benzopyran-7-yl)-3-pyridinecarboxylic acid IUPAC Name: 5-(4-decoxydecoxy)-4-(4-oxo-3-phenylchromen-7-yl)pyridine-3-carboxylic acid Traditional Name: 5-(4-decoxydecoxy)-4-(4-keto-3-phenyl-chromen-7-yl)nicotinic acid Formula: C41H53NO6 MolecularWeight: 655.86262

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC(CCCCCC)CCCOC1=C(C(=CN=C1)C(=O)O)C2=CC3=C(C=C2)C(=O)C(=CO3)C4=CC=CC=C4

Isomeric SMILES

CCCCCCCCCCOC(CCCCCC)CCCOC1=C(C(=CN=C1)C(=O)O)C2=CC3=C(C=C2)C(=O)C(=CO3)C4=CC=CC=C4

InChI

InChI=1S/C41H53NO6/c1-3-5-7-9-10-11-12-17-25-46-33(21-16-8-6-4-2)22-18-26-47-38-29-42-28-35(41(44)45)39(38)32-23-24-34-37(27-32)48-30-36(40(34)43)31-19-14-13-15-20-31/h13-15,19-20,23-24,27-30,33H,3-12,16-18,21-22,25-26H2,1-2H3,(H,44,45)