2-ethyl-N,N-dimethyl-aniline; 2,4,6-trinitrophenol

Systemtic Name: 2-ethyl-N,N-dimethyl-aniline; 2,4,6-trinitrophenol Openeye Name: 2-ethyl-N,N-dimethyl-aniline; picric acid CAS Name: 2-ethyl-N,N-dimethylaniline; 2,4,6-trinitrophenol IUPAC Name: 2-ethyl-N,N-dimethylaniline; 2,4,6-trinitrophenol Traditional Name: (2-ethylphenyl)-dimethyl-amine; picric acid Formula: C16H18N4O7 MolecularWeight: 378.33672

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1N(C)C.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCC1=CC=CC=C1N(C)C.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C10H15N.C6H3N3O7/c1-4-9-7-5-6-8-10(9)11(2)3;10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16/h5-8H,4H2,1-3H3;1-2,10H