sodium 2-[3,5-diethyl-4-[(6-methyl-7-oxidanyl-2,3-dihydro-1H-inden-4-yl)methyl]pyrazol-1-yl]ethanoate

Systemtic Name: sodium 2-[3,5-diethyl-4-[(6-methyl-7-oxidanyl-2,3-dihydro-1H-inden-4-yl)methyl]pyrazol-1-yl]ethanoate Openeye Name: sodium 2-[3,5-diethyl-4-[(7-hydroxy-6-methyl-indan-4-yl)methyl]pyrazol-1-yl]acetate CAS Name: sodium 2-[3,5-diethyl-4-[(7-hydroxy-6-methyl-2,3-dihydro-1H-inden-4-yl)methyl]-1-pyrazolyl]acetate IUPAC Name: sodium 2-[3,5-diethyl-4-[(7-hydroxy-6-methyl-2,3-dihydro-1H-inden-4-yl)methyl]pyrazol-1-yl]acetate Traditional Name: sodium 2-[3,5-diethyl-4-[(7-hydroxy-6-methyl-indan-4-yl)methyl]pyrazol-1-yl]acetate Formula: C20H25N2NaO3 MolecularWeight: 364.41387

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NN1CC(=O)[O-])CC)CC2=CC(=C(C3=C2CCC3)O)C.[Na+]

Isomeric SMILES

CCC1=C(C(=NN1CC(=O)[O-])CC)CC2=CC(=C(C3=C2CCC3)O)C.[Na+]

InChI

InChI=1S/C20H26N2O3.Na/c1-4-17-16(18(5-2)22(21-17)11-19(23)24)10-13-9-12(3)20(25)15-8-6-7-14(13)15;/h9,25H,4-8,10-11H2,1-3H3,(H,23,24);/q;+1/p-1