1,2,3,8a-tetrahydroindolizine; 2,4,6-trinitrophenolate

Systemtic Name: 1,2,3,8a-tetrahydroindolizine; 2,4,6-trinitrophenolate Openeye Name: 1,2,3,8a-tetrahydroindolizine; 2,4,6-trinitrophenolate CAS Name: 1,2,3,8a-tetrahydroindolizine; 2,4,6-trinitrophenolate IUPAC Name: 1,2,3,8a-tetrahydroindolizine; 2,4,6-trinitrophenolate Traditional Name: 1,2,3,8a-tetrahydroindolizine picrate Formula: C14H13N4O7- MolecularWeight: 349.27562

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2C=CC=CN2C1.C1=C(C=C(C(=C1[N+](=O)[O-])[O-])[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1CC2C=CC=CN2C1.C1=C(C=C(C(=C1[N+](=O)[O-])[O-])[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C8H11N.C6H3N3O7/c1-2-6-9-7-3-5-8(9)4-1;10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16/h1-2,4,6,8H,3,5,7H2;1-2,10H/p-1