4-ethoxy-3-(1-methyl-3-propyl-4,7-dihydropyrazolo[4,3-d]pyrimidin-5-yl)benzoic acid

Systemtic Name: 4-ethoxy-3-(1-methyl-3-propyl-4,7-dihydropyrazolo[4,3-d]pyrimidin-5-yl)benzoic acid Openeye Name: 4-ethoxy-3-(1-methyl-3-propyl-4,7-dihydropyrazolo[4,3-d]pyrimidin-5-yl)benzoic acid CAS Name: 4-ethoxy-3-(1-methyl-3-propyl-4,7-dihydropyrazolo[4,3-d]pyrimidin-5-yl)benzoic acid IUPAC Name: 4-ethoxy-3-(1-methyl-3-propyl-4,7-dihydropyrazolo[4,3-d]pyrimidin-5-yl)benzoic acid Traditional Name: 4-ethoxy-3-(1-methyl-3-propyl-4,7-dihydropyrazolo[4,3-d]pyrimidin-5-yl)benzoic acid Formula: C18H22N4O3 MolecularWeight: 342.39228

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C2=C1NC(=NC2)C3=C(C=CC(=C3)C(=O)O)OCC)C

Isomeric SMILES

CCCC1=NN(C2=C1NC(=NC2)C3=C(C=CC(=C3)C(=O)O)OCC)C

InChI

InChI=1S/C18H22N4O3/c1-4-6-13-16-14(22(3)21-13)10-19-17(20-16)12-9-11(18(23)24)7-8-15(12)25-5-2/h7-9H,4-6,10H2,1-3H3,(H,19,20)(H,23,24)