N'-(2-bromanyl-4-methyl-phenyl)-N-[(2,4-dinitrophenyl)amino]propanimidamide

Systemtic Name: N'-(2-bromanyl-4-methyl-phenyl)-N-[(2,4-dinitrophenyl)amino]propanimidamide Openeye Name: N'-(2-bromo-4-methyl-phenyl)-N-(2,4-dinitroanilino)propanamidine CAS Name: N'-(2-bromo-4-methylphenyl)-N-(2,4-dinitroanilino)propanimidamide IUPAC Name: N'-(2-bromo-4-methylphenyl)-N-(2,4-dinitroanilino)propanimidamide Traditional Name: N'-(2-bromo-4-methyl-phenyl)-N-(2,4-dinitroanilino)propionamidine Formula: C16H16BrN5O4 MolecularWeight: 422.23334

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=NC1=C(C=C(C=C1)C)Br)NNC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCC(=NC1=C(C=C(C=C1)C)Br)NNC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C16H16BrN5O4/c1-3-16(18-13-6-4-10(2)8-12(13)17)20-19-14-7-5-11(21(23)24)9-15(14)22(25)26/h4-9,19H,3H2,1-2H3,(H,18,20)