5-[[5-but-3-enyl-3-(methoxymethyl)pyrazol-1-yl]methyl]-2-phenyl-benzoic acid

Systemtic Name: 5-[[5-but-3-enyl-3-(methoxymethyl)pyrazol-1-yl]methyl]-2-phenyl-benzoic acid Openeye Name: 5-[[5-but-3-enyl-3-(methoxymethyl)pyrazol-1-yl]methyl]-2-phenyl-benzoic acid CAS Name: 5-[[5-but-3-enyl-3-(methoxymethyl)-1-pyrazolyl]methyl]-2-phenylbenzoic acid IUPAC Name: 5-[[5-but-3-enyl-3-(methoxymethyl)pyrazol-1-yl]methyl]-2-phenylbenzoic acid Traditional Name: 5-[[5-but-3-enyl-3-(methoxymethyl)pyrazol-1-yl]methyl]-2-phenyl-benzoic acid Formula: C23H24N2O3 MolecularWeight: 376.44826

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Descriptors Computed from Structure

Canonical SMILES:

COCC1=NN(C(=C1)CCC=C)CC2=CC(=C(C=C2)C3=CC=CC=C3)C(=O)O

Isomeric SMILES

COCC1=NN(C(=C1)CCC=C)CC2=CC(=C(C=C2)C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C23H24N2O3/c1-3-4-10-20-14-19(16-28-2)24-25(20)15-17-11-12-21(22(13-17)23(26)27)18-8-6-5-7-9-18/h3,5-9,11-14H,1,4,10,15-16H2,2H3,(H,26,27)