1-[[2-(2-chloroethyl)phenyl]methyl]-5-nitro-2H-indazol-3-one

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CCCl)CN2C3=C(C=C(C=C3)[N+](=O)[O-])C(=O)N2

Isomeric SMILES

C1=CC=C(C(=C1)CCCl)CN2C3=C(C=C(C=C3)[N+](=O)[O-])C(=O)N2

InChI

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