(7-chloranyl-1,3-benzodioxol-5-yl)methyl 4-pyrazol-1-ylbenzoate

Systemtic Name: (7-chloranyl-1,3-benzodioxol-5-yl)methyl 4-pyrazol-1-ylbenzoate Openeye Name: (7-chloro-1,3-benzodioxol-5-yl)methyl 4-pyrazol-1-ylbenzoate CAS Name: 4-(1-pyrazolyl)benzoic acid (7-chloro-1,3-benzodioxol-5-yl)methyl ester IUPAC Name: (7-chloro-1,3-benzodioxol-5-yl)methyl 4-pyrazol-1-ylbenzoate Traditional Name: 4-pyrazol-1-ylbenzoic acid (7-chloro-1,3-benzodioxol-5-yl)methyl ester Formula: C18H13ClN2O4 MolecularWeight: 356.75982

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C(=CC(=C2)COC(=O)C3=CC=C(C=C3)N4C=CC=N4)Cl

Isomeric SMILES

C1OC2=C(O1)C(=CC(=C2)COC(=O)C3=CC=C(C=C3)N4C=CC=N4)Cl

InChI

InChI=1S/C18H13ClN2O4/c19-15-8-12(9-16-17(15)25-11-24-16)10-23-18(22)13-2-4-14(5-3-13)21-7-1-6-20-21/h1-9H,10-11H2