2-[2-[2-[(3,5-dimethoxy-4-methyl-phenyl)-oxidanyl-methyl]-5-phenyl-pentyl]-5-methyl-pyrazol-3-yl]ethanoic acid

Systemtic Name: 2-[2-[2-[(3,5-dimethoxy-4-methyl-phenyl)-oxidanyl-methyl]-5-phenyl-pentyl]-5-methyl-pyrazol-3-yl]ethanoic acid Openeye Name: 2-[2-[2-[(3,5-dimethoxy-4-methyl-phenyl)-hydroxy-methyl]-5-phenyl-pentyl]-5-methyl-pyrazol-3-yl]acetic acid CAS Name: 2-[2-[2-[(3,5-dimethoxy-4-methylphenyl)-hydroxymethyl]-5-phenylpentyl]-5-methyl-3-pyrazolyl]acetic acid IUPAC Name: 2-[2-[2-[(3,5-dimethoxy-4-methylphenyl)-hydroxymethyl]-5-phenylpentyl]-5-methylpyrazol-3-yl]acetic acid Traditional Name: 2-[2-[2-[(3,5-dimethoxy-4-methyl-phenyl)-hydroxy-methyl]-5-phenyl-pentyl]-5-methyl-pyrazol-3-yl]acetic acid Formula: C27H34N2O5 MolecularWeight: 466.56926

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)CC(=O)O)CC(CCCC2=CC=CC=C2)C(C3=CC(=C(C(=C3)OC)C)OC)O

Isomeric SMILES

CC1=NN(C(=C1)CC(=O)O)CC(CCCC2=CC=CC=C2)C(C3=CC(=C(C(=C3)OC)C)OC)O

InChI

InChI=1S/C27H34N2O5/c1-18-13-23(16-26(30)31)29(28-18)17-21(12-8-11-20-9-6-5-7-10-20)27(32)22-14-24(33-3)19(2)25(15-22)34-4/h5-7,9-10,13-15,21,27,32H,8,11-12,16-17H2,1-4H3,(H,30,31)