2'-methylspiro[cyclohexane-1,3'-indole]; 2,4,6-trinitrophenol

Systemtic Name: 2'-methylspiro[cyclohexane-1,3'-indole]; 2,4,6-trinitrophenol Openeye Name: 2'-methylspiro[cyclohexane-1,3'-indole]; picric acid CAS Name: 2'-methylspiro[cyclohexane-1,3'-indole]; 2,4,6-trinitrophenol IUPAC Name: 2'-methylspiro[cyclohexane-1,3'-indole]; 2,4,6-trinitrophenol Traditional Name: 2'-methylspiro[cyclohexane-1,3'-indole]; picric acid Formula: C20H20N4O7 MolecularWeight: 428.3954

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C13CCCCC3.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=NC2=CC=CC=C2C13CCCCC3.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C14H17N.C6H3N3O7/c1-11-14(9-5-2-6-10-14)12-7-3-4-8-13(12)15-11;10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16/h3-4,7-8H,2,5-6,9-10H2,1H3;1-2,10H