3-[5-(1,3-benzodioxol-5-yl)-1-(4-methoxyphenyl)pyrazol-3-yl]-2-naphthalen-1-yl-propanoic acid

Systemtic Name: 3-[5-(1,3-benzodioxol-5-yl)-1-(4-methoxyphenyl)pyrazol-3-yl]-2-naphthalen-1-yl-propanoic acid Openeye Name: 3-[5-(1,3-benzodioxol-5-yl)-1-(4-methoxyphenyl)pyrazol-3-yl]-2-(1-naphthyl)propanoic acid CAS Name: 3-[5-(1,3-benzodioxol-5-yl)-1-(4-methoxyphenyl)-3-pyrazolyl]-2-(1-naphthalenyl)propanoic acid IUPAC Name: 3-[5-(1,3-benzodioxol-5-yl)-1-(4-methoxyphenyl)pyrazol-3-yl]-2-naphthalen-1-ylpropanoic acid Traditional Name: 3-[5-(1,3-benzodioxol-5-yl)-1-(4-methoxyphenyl)pyrazol-3-yl]-2-(1-naphthyl)propionic acid Formula: C30H24N2O5 MolecularWeight: 492.52196

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(=CC(=N2)CC(C3=CC=CC4=CC=CC=C43)C(=O)O)C5=CC6=C(C=C5)OCO6

Isomeric SMILES

COC1=CC=C(C=C1)N2C(=CC(=N2)CC(C3=CC=CC4=CC=CC=C43)C(=O)O)C5=CC6=C(C=C5)OCO6

InChI

InChI=1S/C30H24N2O5/c1-35-23-12-10-22(11-13-23)32-27(20-9-14-28-29(15-20)37-18-36-28)17-21(31-32)16-26(30(33)34)25-8-4-6-19-5-2-3-7-24(19)25/h2-15,17,26H,16,18H2,1H3,(H,33,34)