N2-(4-chlorophenyl)-N4,N4-bis(2-methoxyethyl)-5-nitro-pyrimidine-2,4-diamine

Systemtic Name: N2-(4-chlorophenyl)-N4,N4-bis(2-methoxyethyl)-5-nitro-pyrimidine-2,4-diamine Openeye Name: N2-(4-chlorophenyl)-N4,N4-bis(2-methoxyethyl)-5-nitro-pyrimidine-2,4-diamine CAS Name: N2-(4-chlorophenyl)-N4,N4-bis(2-methoxyethyl)-5-nitropyrimidine-2,4-diamine IUPAC Name: 2-N-(4-chlorophenyl)-4-N,4-N-bis(2-methoxyethyl)-5-nitropyrimidine-2,4-diamine Traditional Name: [2-(4-chloroanilino)-5-nitro-pyrimidin-4-yl]-bis(2-methoxyethyl)amine Formula: C16H20ClN5O4 MolecularWeight: 381.8141

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Descriptors Computed from Structure

Canonical SMILES:

COCCN(CCOC)C1=NC(=NC=C1[N+](=O)[O-])NC2=CC=C(C=C2)Cl

Isomeric SMILES

COCCN(CCOC)C1=NC(=NC=C1[N+](=O)[O-])NC2=CC=C(C=C2)Cl

InChI

InChI=1S/C16H20ClN5O4/c1-25-9-7-21(8-10-26-2)15-14(22(23)24)11-18-16(20-15)19-13-5-3-12(17)4-6-13/h3-6,11H,7-10H2,1-2H3,(H,18,19,20)