4-[5-azanyl-3-(methoxymethyl)-4-phenyl-pyrazol-1-yl]benzoic acid

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

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Descriptors Computed from Structure

Canonical SMILES:

COCC1=NN(C(=C1C2=CC=CC=C2)N)C3=CC=C(C=C3)C(=O)O

Isomeric SMILES

COCC1=NN(C(=C1C2=CC=CC=C2)N)C3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C18H17N3O3/c1-24-11-15-16(12-5-3-2-4-6-12)17(19)21(20-15)14-9-7-13(8-10-14)18(22)23/h2-10H,11,19H2,1H3,(H,22,23)