2-[3-(3,4-dichlorophenyl)-1-(3-nitrophenyl)pyrazol-4-yl]ethanoic acid

Systemtic Name: 2-[3-(3,4-dichlorophenyl)-1-(3-nitrophenyl)pyrazol-4-yl]ethanoic acid Openeye Name: 2-[3-(3,4-dichlorophenyl)-1-(3-nitrophenyl)pyrazol-4-yl]acetic acid CAS Name: 2-[3-(3,4-dichlorophenyl)-1-(3-nitrophenyl)-4-pyrazolyl]acetic acid IUPAC Name: 2-[3-(3,4-dichlorophenyl)-1-(3-nitrophenyl)pyrazol-4-yl]acetic acid Traditional Name: 2-[3-(3,4-dichlorophenyl)-1-(3-nitrophenyl)pyrazol-4-yl]acetic acid Formula: C17H11Cl2N3O4 MolecularWeight: 392.19294

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H11Cl2N3O4/c18-14-5-4-10(6-15(14)19)17-11(7-16(23)24)9-21(20-17)12-2-1-3-13(8-12)22(25)26/h1-6,8-9H,7H2,(H,23,24)