7-[3-[4-(2,3-dihydro-1H-pyrazol-3-yl)-2-ethyl-5-oxidanyl-phenoxy]propoxy]-8-propyl-3,4-dihydro-2H-chromene-2-carboxylic acid

Systemtic Name: 7-[3-[4-(2,3-dihydro-1H-pyrazol-3-yl)-2-ethyl-5-oxidanyl-phenoxy]propoxy]-8-propyl-3,4-dihydro-2H-chromene-2-carboxylic acid Openeye Name: 7-[3-[4-(2,3-dihydro-1H-pyrazol-3-yl)-2-ethyl-5-hydroxy-phenoxy]propoxy]-8-propyl-chromane-2-carboxylic acid CAS Name: 7-[3-[4-(2,3-dihydro-1H-pyrazol-3-yl)-2-ethyl-5-hydroxyphenoxy]propoxy]-8-propyl-3,4-dihydro-2H-1-benzopyran-2-carboxylic acid IUPAC Name: 7-[3-[4-(2,3-dihydro-1H-pyrazol-3-yl)-2-ethyl-5-hydroxyphenoxy]propoxy]-8-propyl-3,4-dihydro-2H-chromene-2-carboxylic acid Traditional Name: 7-[3-[2-ethyl-5-hydroxy-4-(3-pyrazolin-3-yl)phenoxy]propoxy]-8-propyl-chroman-2-carboxylic acid Formula: C27H34N2O6 MolecularWeight: 482.56866

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC2=C1OC(CC2)C(=O)O)OCCCOC3=C(C=C(C(=C3)O)C4C=CNN4)CC

Isomeric SMILES

CCCC1=C(C=CC2=C1OC(CC2)C(=O)O)OCCCOC3=C(C=C(C(=C3)O)C4C=CNN4)CC

InChI

InChI=1S/C27H34N2O6/c1-3-6-19-23(9-7-18-8-10-24(27(31)32)35-26(18)19)33-13-5-14-34-25-16-22(30)20(15-17(25)4-2)21-11-12-28-29-21/h7,9,11-12,15-16,21,24,28-30H,3-6,8,10,13-14H2,1-2H3,(H,31,32)