N-[(E)-[2-[bis(2-methylpropyl)amino]-5-nitro-phenyl]methylideneamino]-3-bromanyl-benzamide

Systemtic Name: N-[(E)-[2-[bis(2-methylpropyl)amino]-5-nitro-phenyl]methylideneamino]-3-bromanyl-benzamide Openeye Name: 3-bromo-N-[(E)-[2-(diisobutylamino)-5-nitro-phenyl]methyleneamino]benzamide CAS Name: N-[(E)-[2-[bis(2-methylpropyl)amino]-5-nitrophenyl]methylideneamino]-3-bromobenzamide IUPAC Name: N-[(E)-[2-[bis(2-methylpropyl)amino]-5-nitrophenyl]methylideneamino]-3-bromobenzamide Traditional Name: 3-bromo-N-[(E)-[2-(diisobutylamino)-5-nitro-benzylidene]amino]benzamide Formula: C22H27BrN4O3 MolecularWeight: 475.37878

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC(C)C)C1=C(C=C(C=C1)[N+](=O)[O-])C=NNC(=O)C2=CC(=CC=C2)Br

Isomeric SMILES

CC(C)CN(CC(C)C)C1=C(C=C(C=C1)[N+](=O)[O-])/C=N/NC(=O)C2=CC(=CC=C2)Br

InChI

InChI=1S/C22H27BrN4O3/c1-15(2)13-26(14-16(3)4)21-9-8-20(27(29)30)11-18(21)12-24-25-22(28)17-6-5-7-19(23)10-17/h5-12,15-16H,13-14H2,1-4H3,(H,25,28)/b24-12+