3-[3-(3-aminophenyl)-1-phenyl-pyrazol-4-yl]propanoate

Systemtic Name: 3-[3-(3-aminophenyl)-1-phenyl-pyrazol-4-yl]propanoate Openeye Name: 3-[3-(3-aminophenyl)-1-phenyl-pyrazol-4-yl]propanoate CAS Name: 3-[3-(3-aminophenyl)-1-phenyl-4-pyrazolyl]propanoate IUPAC Name: 3-[3-(3-aminophenyl)-1-phenylpyrazol-4-yl]propanoate Traditional Name: 3-[3-(3-aminophenyl)-1-phenyl-pyrazol-4-yl]propionate Formula: C18H16N3O2- MolecularWeight: 306.33854

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC(=CC=C3)N)CCC(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC(=CC=C3)N)CCC(=O)[O-]

InChI

InChI=1S/C18H17N3O2/c19-15-6-4-5-13(11-15)18-14(9-10-17(22)23)12-21(20-18)16-7-2-1-3-8-16/h1-8,11-12H,9-10,19H2,(H,22,23)/p-1