2-[[3,5-dimethyl-4-[(6-methyl-7-oxidanyl-2,3-dihydro-1H-inden-4-yl)methyl]pyrazol-1-yl]methyl]pentanedioic acid

Systemtic Name: 2-[[3,5-dimethyl-4-[(6-methyl-7-oxidanyl-2,3-dihydro-1H-inden-4-yl)methyl]pyrazol-1-yl]methyl]pentanedioic acid Openeye Name: 2-[[4-[(7-hydroxy-6-methyl-indan-4-yl)methyl]-3,5-dimethyl-pyrazol-1-yl]methyl]pentanedioic acid CAS Name: 2-[[4-[(7-hydroxy-6-methyl-2,3-dihydro-1H-inden-4-yl)methyl]-3,5-dimethyl-1-pyrazolyl]methyl]pentanedioic acid IUPAC Name: 2-[[4-[(7-hydroxy-6-methyl-2,3-dihydro-1H-inden-4-yl)methyl]-3,5-dimethylpyrazol-1-yl]methyl]pentanedioic acid Traditional Name: 2-[[4-[(7-hydroxy-6-methyl-indan-4-yl)methyl]-3,5-dimethyl-pyrazol-1-yl]methyl]glutaric acid Formula: C22H28N2O5 MolecularWeight: 400.46812

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(CCC2)C(=C1)CC3=C(N(N=C3C)CC(CCC(=O)O)C(=O)O)C)O

Isomeric SMILES

CC1=C(C2=C(CCC2)C(=C1)CC3=C(N(N=C3C)CC(CCC(=O)O)C(=O)O)C)O

InChI

InChI=1S/C22H28N2O5/c1-12-9-16(17-5-4-6-18(17)21(12)27)10-19-13(2)23-24(14(19)3)11-15(22(28)29)7-8-20(25)26/h9,15,27H,4-8,10-11H2,1-3H3,(H,25,26)(H,28,29)