4-azanyl-2-(4-methoxyphenyl)-6-(4-nitrophenyl)pyrimidine-5-carbonitrile

Systemtic Name: 4-azanyl-2-(4-methoxyphenyl)-6-(4-nitrophenyl)pyrimidine-5-carbonitrile Openeye Name: 4-amino-2-(4-methoxyphenyl)-6-(4-nitrophenyl)pyrimidine-5-carbonitrile CAS Name: 4-amino-2-(4-methoxyphenyl)-6-(4-nitrophenyl)-5-pyrimidinecarbonitrile IUPAC Name: 4-amino-2-(4-methoxyphenyl)-6-(4-nitrophenyl)pyrimidine-5-carbonitrile Traditional Name: 4-amino-2-(4-methoxyphenyl)-6-(4-nitrophenyl)pyrimidine-5-carbonitrile Formula: C18H13N5O3 MolecularWeight: 347.32752

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NC(=C(C(=N2)N)C#N)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)C2=NC(=C(C(=N2)N)C#N)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H13N5O3/c1-26-14-8-4-12(5-9-14)18-21-16(15(10-19)17(20)22-18)11-2-6-13(7-3-11)23(24)25/h2-9H,1H3,(H2,20,21,22)