1-methyl-1,2,3,4-tetrahydrophenanthren-9-amine; 2,4,6-trinitrophenol

Systemtic Name: 1-methyl-1,2,3,4-tetrahydrophenanthren-9-amine; 2,4,6-trinitrophenol Openeye Name: 1-methyl-1,2,3,4-tetrahydrophenanthren-9-amine; picric acid CAS Name: 1-methyl-1,2,3,4-tetrahydrophenanthren-9-amine; 2,4,6-trinitrophenol IUPAC Name: 1-methyl-1,2,3,4-tetrahydrophenanthren-9-amine; 2,4,6-trinitrophenol Traditional Name: (1-methyl-1,2,3,4-tetrahydrophenanthren-9-yl)amine; picric acid Formula: C21H20N4O7 MolecularWeight: 440.4061

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC2=C1C=C(C3=CC=CC=C23)N.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1CCCC2=C1C=C(C3=CC=CC=C23)N.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C15H17N.C6H3N3O7/c1-10-5-4-8-12-11-6-2-3-7-13(11)15(16)9-14(10)12;10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16/h2-3,6-7,9-10H,4-5,8,16H2,1H3;1-2,10H