3-[2-(2-chlorophenyl)ethyl]-4-methyl-5-nitro-benzene-1,2-diol

Systemtic Name: 3-[2-(2-chlorophenyl)ethyl]-4-methyl-5-nitro-benzene-1,2-diol Openeye Name: 3-[2-(2-chlorophenyl)ethyl]-4-methyl-5-nitro-benzene-1,2-diol CAS Name: 3-[2-(2-chlorophenyl)ethyl]-4-methyl-5-nitrobenzene-1,2-diol IUPAC Name: 3-[2-(2-chlorophenyl)ethyl]-4-methyl-5-nitrobenzene-1,2-diol Traditional Name: 3-[2-(2-chlorophenyl)ethyl]-4-methyl-5-nitro-pyrocatechol Formula: C15H14ClNO4 MolecularWeight: 307.72896

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1[N+](=O)[O-])O)O)CCC2=CC=CC=C2Cl

Isomeric SMILES

CC1=C(C(=C(C=C1[N+](=O)[O-])O)O)CCC2=CC=CC=C2Cl

InChI

InChI=1S/C15H14ClNO4/c1-9-11(7-6-10-4-2-3-5-12(10)16)15(19)14(18)8-13(9)17(20)21/h2-5,8,18-19H,6-7H2,1H3