N-ethylnaphthalen-2-amine; 2,4,6-trinitrophenol

Systemtic Name: N-ethylnaphthalen-2-amine; 2,4,6-trinitrophenol Openeye Name: N-ethylnaphthalen-2-amine; picric acid CAS Name: N-ethyl-2-naphthalenamine; 2,4,6-trinitrophenol IUPAC Name: N-ethylnaphthalen-2-amine; 2,4,6-trinitrophenol Traditional Name: ethyl(2-naphthyl)amine; picric acid Formula: C18H16N4O7 MolecularWeight: 400.34224

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=CC2=CC=CC=C2C=C1.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCNC1=CC2=CC=CC=C2C=C1.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C12H13N.C6H3N3O7/c1-2-13-12-8-7-10-5-3-4-6-11(10)9-12;10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16/h3-9,13H,2H2,1H3;1-2,10H