1-[2-[2-(chloromethyl)phenyl]ethyl]-5-nitro-2H-indazol-3-one

Systemtic Name: 1-[2-[2-(chloromethyl)phenyl]ethyl]-5-nitro-2H-indazol-3-one Openeye Name: 1-[2-[2-(chloromethyl)phenyl]ethyl]-5-nitro-2H-indazol-3-one CAS Name: 1-[2-[2-(chloromethyl)phenyl]ethyl]-5-nitro-2H-indazol-3-one IUPAC Name: 1-[2-[2-(chloromethyl)phenyl]ethyl]-5-nitro-2H-indazol-3-one Traditional Name: 1-[2-[2-(chloromethyl)phenyl]ethyl]-5-nitro-indazolin-3-one Formula: C16H14ClN3O3 MolecularWeight: 331.75366

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CCN2C3=C(C=C(C=C3)[N+](=O)[O-])C(=O)N2)CCl

Isomeric SMILES

C1=CC=C(C(=C1)CCN2C3=C(C=C(C=C3)[N+](=O)[O-])C(=O)N2)CCl

InChI

InChI=1S/C16H14ClN3O3/c17-10-12-4-2-1-3-11(12)7-8-19-15-6-5-13(20(22)23)9-14(15)16(21)18-19/h1-6,9H,7-8,10H2,(H,18,21)