1-[bis(4-isocyanatophenyl)methyl]-2-nitro-benzene

Systemtic Name: 1-[bis(4-isocyanatophenyl)methyl]-2-nitro-benzene Openeye Name: 1-[bis(4-isocyanatophenyl)methyl]-2-nitro-benzene CAS Name: 1-[bis(4-isocyanatophenyl)methyl]-2-nitrobenzene IUPAC Name: 1-[bis(4-isocyanatophenyl)methyl]-2-nitrobenzene Traditional Name: 1-[bis(4-isocyanatophenyl)methyl]-2-nitro-benzene Formula: C21H13N3O4 MolecularWeight: 371.34562

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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