1-isocyanato-4-[(4-isocyanatophenyl)-(4-nitrophenyl)methyl]benzene

Systemtic Name: 1-isocyanato-4-[(4-isocyanatophenyl)-(4-nitrophenyl)methyl]benzene Openeye Name: 1-isocyanato-4-[(4-isocyanatophenyl)-(4-nitrophenyl)methyl]benzene CAS Name: 1-isocyanato-4-[(4-isocyanatophenyl)-(4-nitrophenyl)methyl]benzene IUPAC Name: 1-isocyanato-4-[(4-isocyanatophenyl)-(4-nitrophenyl)methyl]benzene Traditional Name: 1-isocyanato-4-[(4-isocyanatophenyl)-(4-nitrophenyl)methyl]benzene Formula: C21H13N3O4 MolecularWeight: 371.34562

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(C2=CC=C(C=C2)N=C=O)C3=CC=C(C=C3)[N+](=O)[O-])N=C=O

Isomeric SMILES

C1=CC(=CC=C1C(C2=CC=C(C=C2)N=C=O)C3=CC=C(C=C3)[N+](=O)[O-])N=C=O

InChI

InChI=1S/C21H13N3O4/c25-13-22-18-7-1-15(2-8-18)21(16-3-9-19(10-4-16)23-14-26)17-5-11-20(12-6-17)24(27)28/h1-12,21H