N-(3-morpholin-4-yl-2,4,6-trinitro-phenyl)carbazol-9-amine

Systemtic Name: N-(3-morpholin-4-yl-2,4,6-trinitro-phenyl)carbazol-9-amine Openeye Name: N-(3-morpholino-2,4,6-trinitro-phenyl)carbazol-9-amine CAS Name: N-[3-(4-morpholinyl)-2,4,6-trinitrophenyl]-9-carbazolamine IUPAC Name: N-(3-morpholin-4-yl-2,4,6-trinitrophenyl)carbazol-9-amine Traditional Name: carbazol-9-yl-(3-morpholino-2,4,6-trinitro-phenyl)amine Formula: C22H18N6O7 MolecularWeight: 478.41432

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C(=C(C=C2[N+](=O)[O-])[N+](=O)[O-])NN3C4=CC=CC=C4C5=CC=CC=C53)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1C2=C(C(=C(C=C2[N+](=O)[O-])[N+](=O)[O-])NN3C4=CC=CC=C4C5=CC=CC=C53)[N+](=O)[O-]

InChI

InChI=1S/C22H18N6O7/c29-26(30)18-13-19(27(31)32)21(24-9-11-35-12-10-24)22(28(33)34)20(18)23-25-16-7-3-1-5-14(16)15-6-2-4-8-17(15)25/h1-8,13,23H,9-12H2