5-chloranyl-3-(phenylmethyl)-1,2-dihydroindazol-6-one

Systemtic Name: 5-chloranyl-3-(phenylmethyl)-1,2-dihydroindazol-6-one Openeye Name: 3-benzyl-5-chloro-1,2-dihydroindazol-6-one CAS Name: 5-chloro-3-(phenylmethyl)-1,2-dihydroindazol-6-one IUPAC Name: 3-benzyl-5-chloro-1,2-dihydroindazol-6-one Traditional Name: 3-benzyl-5-chloro-1,2-dihydroindazol-6-one Formula: C14H11ClN2O MolecularWeight: 258.70294

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=C3C=C(C(=O)C=C3NN2)Cl

Isomeric SMILES

C1=CC=C(C=C1)CC2=C3C=C(C(=O)C=C3NN2)Cl

InChI

InChI=1S/C14H11ClN2O/c15-11-7-10-12(6-9-4-2-1-3-5-9)16-17-13(10)8-14(11)18/h1-5,7-8,16-17H,6H2