N-[4-[4-(carbazol-9-ylamino)-3,5-dinitro-phenyl]-2,6-dinitro-phenyl]carbazol-9-amine

Systemtic Name: N-[4-[4-(carbazol-9-ylamino)-3,5-dinitro-phenyl]-2,6-dinitro-phenyl]carbazol-9-amine Openeye Name: N-[4-[4-(carbazol-9-ylamino)-3,5-dinitro-phenyl]-2,6-dinitro-phenyl]carbazol-9-amine CAS Name: N-[4-[4-(9-carbazolylamino)-3,5-dinitrophenyl]-2,6-dinitrophenyl]-9-carbazolamine IUPAC Name: N-[4-[4-(carbazol-9-ylamino)-3,5-dinitrophenyl]-2,6-dinitrophenyl]carbazol-9-amine Traditional Name: carbazol-9-yl-[4-[4-(carbazol-9-ylamino)-3,5-dinitro-phenyl]-2,6-dinitro-phenyl]amine Formula: C36H22N8O8 MolecularWeight: 694.60868

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C3=CC=CC=C3N2NC4=C(C=C(C=C4[N+](=O)[O-])C5=CC(=C(C(=C5)[N+](=O)[O-])NN6C7=CC=CC=C7C8=CC=CC=C86)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C3=CC=CC=C3N2NC4=C(C=C(C=C4[N+](=O)[O-])C5=CC(=C(C(=C5)[N+](=O)[O-])NN6C7=CC=CC=C7C8=CC=CC=C86)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C36H22N8O8/c45-41(46)31-17-21(18-32(42(47)48)35(31)37-39-27-13-5-1-9-23(27)24-10-2-6-14-28(24)39)22-19-33(43(49)50)36(34(20-22)44(51)52)38-40-29-15-7-3-11-25(29)26-12-4-8-16-30(26)40/h1-20,37-38H