3,6,8-trinitro-9H-pyrido[3,4-b]indole

Systemtic Name: 3,6,8-trinitro-9H-pyrido[3,4-b]indole Openeye Name: 3,6,8-trinitro-9H-pyrido[3,4-b]indole CAS Name: 3,6,8-trinitro-9H-pyrido[3,4-b]indole IUPAC Name: 3,6,8-trinitro-9H-pyrido[3,4-b]indole Traditional Name: 3,6,8-trinitro-9H-$b-carboline Formula: C11H5N5O6 MolecularWeight: 303.1873

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C2C3=CC(=NC=C3NC2=C1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=C(C=C2C3=CC(=NC=C3NC2=C1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C11H5N5O6/c17-14(18)5-1-7-6-3-10(16(21)22)12-4-8(6)13-11(7)9(2-5)15(19)20/h1-4,13H