6-chloranyl-N4-[[3-methoxy-4-[(4-nitrophenyl)methoxy]phenyl]methylideneamino]pyrimidine-4,5-diamine

Systemtic Name: 6-chloranyl-N4-[[3-methoxy-4-[(4-nitrophenyl)methoxy]phenyl]methylideneamino]pyrimidine-4,5-diamine Openeye Name: 6-chloro-N4-[[3-methoxy-4-[(4-nitrophenyl)methoxy]phenyl]methyleneamino]pyrimidine-4,5-diamine CAS Name: 6-chloro-N4-[[3-methoxy-4-[(4-nitrophenyl)methoxy]phenyl]methylideneamino]pyrimidine-4,5-diamine IUPAC Name: 6-chloro-4-N-[[3-methoxy-4-[(4-nitrophenyl)methoxy]phenyl]methylideneamino]pyrimidine-4,5-diamine Traditional Name: (5-amino-6-chloro-pyrimidin-4-yl)-[[3-methoxy-4-(4-nitrobenzyl)oxy-benzylidene]amino]amine Formula: C19H17ClN6O4 MolecularWeight: 428.82908

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=NNC2=C(C(=NC=N2)Cl)N)OCC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=CC(=C1)C=NNC2=C(C(=NC=N2)Cl)N)OCC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H17ClN6O4/c1-29-16-8-13(9-24-25-19-17(21)18(20)22-11-23-19)4-7-15(16)30-10-12-2-5-14(6-3-12)26(27)28/h2-9,11H,10,21H2,1H3,(H,22,23,25)