6-chloranyl-N4-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]pyrimidine-2,4-diamine

Systemtic Name: 6-chloranyl-N4-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]pyrimidine-2,4-diamine Openeye Name: 6-chloro-N4-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]pyrimidine-2,4-diamine CAS Name: 6-chloro-N4-[2-(4,5-dimethoxy-2-nitrophenyl)ethyl]pyrimidine-2,4-diamine IUPAC Name: 6-chloro-4-N-[2-(4,5-dimethoxy-2-nitrophenyl)ethyl]pyrimidine-2,4-diamine Traditional Name: (2-amino-6-chloro-pyrimidin-4-yl)-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]amine Formula: C14H16ClN5O4 MolecularWeight: 353.76094

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)CCNC2=CC(=NC(=N2)N)Cl)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C(=C1)CCNC2=CC(=NC(=N2)N)Cl)[N+](=O)[O-])OC

InChI

InChI=1S/C14H16ClN5O4/c1-23-10-5-8(9(20(21)22)6-11(10)24-2)3-4-17-13-7-12(15)18-14(16)19-13/h5-7H,3-4H2,1-2H3,(H3,16,17,18,19)