(2S)-2-chloranyl-1-(4-methyl-3-nitro-phenyl)propan-1-one

Systemtic Name: (2S)-2-chloranyl-1-(4-methyl-3-nitro-phenyl)propan-1-one Openeye Name: (2S)-2-chloro-1-(4-methyl-3-nitro-phenyl)propan-1-one CAS Name: (2S)-2-chloro-1-(4-methyl-3-nitrophenyl)-1-propanone IUPAC Name: (2S)-2-chloro-1-(4-methyl-3-nitrophenyl)propan-1-one Traditional Name: (2S)-2-chloro-1-(4-methyl-3-nitro-phenyl)propan-1-one Formula: C10H10ClNO3 MolecularWeight: 227.6443

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)C(C)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)[C@H](C)Cl)[N+](=O)[O-]

InChI

InChI=1S/C10H10ClNO3/c1-6-3-4-8(10(13)7(2)11)5-9(6)12(14)15/h3-5,7H,1-2H3/t7-/m0/s1