4-[5-azanyl-4-(4-methoxyphenyl)-3-methyl-pyrazol-1-yl]benzoic acid

Systemtic Name: 4-[5-azanyl-4-(4-methoxyphenyl)-3-methyl-pyrazol-1-yl]benzoic acid Openeye Name: 4-[5-amino-4-(4-methoxyphenyl)-3-methyl-pyrazol-1-yl]benzoic acid CAS Name: 4-[5-amino-4-(4-methoxyphenyl)-3-methyl-1-pyrazolyl]benzoic acid IUPAC Name: 4-[5-amino-4-(4-methoxyphenyl)-3-methylpyrazol-1-yl]benzoic acid Traditional Name: 4-[5-amino-4-(4-methoxyphenyl)-3-methyl-pyrazol-1-yl]benzoic acid Formula: C18H17N3O3 MolecularWeight: 323.34588

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C2=CC=C(C=C2)OC)N)C3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CC1=NN(C(=C1C2=CC=C(C=C2)OC)N)C3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C18H17N3O3/c1-11-16(12-5-9-15(24-2)10-6-12)17(19)21(20-11)14-7-3-13(4-8-14)18(22)23/h3-10H,19H2,1-2H3,(H,22,23)