N2-(2-bromanyl-4-propan-2-yl-phenyl)-N4,N4-bis(2-methoxyethyl)-6-methyl-3-nitro-pyridine-2,4-diamine

Systemtic Name: N2-(2-bromanyl-4-propan-2-yl-phenyl)-N4,N4-bis(2-methoxyethyl)-6-methyl-3-nitro-pyridine-2,4-diamine Openeye Name: N2-(2-bromo-4-isopropyl-phenyl)-N4,N4-bis(2-methoxyethyl)-6-methyl-3-nitro-pyridine-2,4-diamine CAS Name: N2-(2-bromo-4-propan-2-ylphenyl)-N4,N4-bis(2-methoxyethyl)-6-methyl-3-nitropyridine-2,4-diamine IUPAC Name: 2-N-(2-bromo-4-propan-2-ylphenyl)-4-N,4-N-bis(2-methoxyethyl)-6-methyl-3-nitropyridine-2,4-diamine Traditional Name: [2-(2-bromo-4-isopropyl-anilino)-6-methyl-3-nitro-4-pyridyl]-bis(2-methoxyethyl)amine Formula: C21H29BrN4O4 MolecularWeight: 481.38336

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(=C1)N(CCOC)CCOC)[N+](=O)[O-])NC2=C(C=C(C=C2)C(C)C)Br

Isomeric SMILES

CC1=NC(=C(C(=C1)N(CCOC)CCOC)[N+](=O)[O-])NC2=C(C=C(C=C2)C(C)C)Br

InChI

InChI=1S/C21H29BrN4O4/c1-14(2)16-6-7-18(17(22)13-16)24-21-20(26(27)28)19(12-15(3)23-21)25(8-10-29-4)9-11-30-5/h6-7,12-14H,8-11H2,1-5H3,(H,23,24)