4-[1-(4-hydroxyphenyl)-2-nitro-ethyl]benzene-1,3-diol

Systemtic Name: 4-[1-(4-hydroxyphenyl)-2-nitro-ethyl]benzene-1,3-diol Openeye Name: 4-[1-(4-hydroxyphenyl)-2-nitro-ethyl]benzene-1,3-diol CAS Name: 4-[1-(4-hydroxyphenyl)-2-nitroethyl]benzene-1,3-diol IUPAC Name: 4-[1-(4-hydroxyphenyl)-2-nitroethyl]benzene-1,3-diol Traditional Name: 4-[1-(4-hydroxyphenyl)-2-nitro-ethyl]resorcinol Formula: C14H13NO5 MolecularWeight: 275.25672

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(C[N+](=O)[O-])C2=C(C=C(C=C2)O)O)O

Isomeric SMILES

C1=CC(=CC=C1C(C[N+](=O)[O-])C2=C(C=C(C=C2)O)O)O

InChI

InChI=1S/C14H13NO5/c16-10-3-1-9(2-4-10)13(8-15(19)20)12-6-5-11(17)7-14(12)18/h1-7,13,16-18H,8H2