N,N'-bis[2-(1,2-benzoxazol-3-yl)-4-chloranyl-phenyl]methanediamine

Systemtic Name: N,N'-bis[2-(1,2-benzoxazol-3-yl)-4-chloranyl-phenyl]methanediamine Openeye Name: N,N'-bis[2-(1,2-benzoxazol-3-yl)-4-chloro-phenyl]methanediamine CAS Name: N,N'-bis[2-(1,2-benzoxazol-3-yl)-4-chlorophenyl]methanediamine IUPAC Name: N,N'-bis[2-(1,2-benzoxazol-3-yl)-4-chlorophenyl]methanediamine Traditional Name: (4-chloro-2-indoxazen-3-yl-anilino)methyl-(4-chloro-2-indoxazen-3-yl-phenyl)amine Formula: C27H18Cl2N4O2 MolecularWeight: 501.36342

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NO2)C3=C(C=CC(=C3)Cl)NCNC4=C(C=C(C=C4)Cl)C5=NOC6=CC=CC=C65

Isomeric SMILES

C1=CC=C2C(=C1)C(=NO2)C3=C(C=CC(=C3)Cl)NCNC4=C(C=C(C=C4)Cl)C5=NOC6=CC=CC=C65

InChI

InChI=1S/C27H18Cl2N4O2/c28-16-9-11-22(20(13-16)26-18-5-1-3-7-24(18)34-32-26)30-15-31-23-12-10-17(29)14-21(23)27-19-6-2-4-8-25(19)35-33-27/h1-14,30-31H,15H2