2-[4-(3-bromanyl-4-methoxy-phenoxy)phenyl]-3,5-bis(oxidanylidene)-1,2,4-triazine-6-carbonitrile

Systemtic Name: 2-[4-(3-bromanyl-4-methoxy-phenoxy)phenyl]-3,5-bis(oxidanylidene)-1,2,4-triazine-6-carbonitrile Openeye Name: 2-[4-(3-bromo-4-methoxy-phenoxy)phenyl]-3,5-dioxo-1,2,4-triazine-6-carbonitrile CAS Name: 2-[4-(3-bromo-4-methoxyphenoxy)phenyl]-3,5-dioxo-1,2,4-triazine-6-carbonitrile IUPAC Name: 2-[4-(3-bromo-4-methoxyphenoxy)phenyl]-3,5-dioxo-1,2,4-triazine-6-carbonitrile Traditional Name: 2-[4-(3-bromo-4-methoxy-phenoxy)phenyl]-3,5-diketo-1,2,4-triazine-6-carbonitrile Formula: C17H11BrN4O4 MolecularWeight: 415.19764

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)OC2=CC=C(C=C2)N3C(=O)NC(=O)C(=N3)C#N)Br

Isomeric SMILES

COC1=C(C=C(C=C1)OC2=CC=C(C=C2)N3C(=O)NC(=O)C(=N3)C#N)Br

InChI

InChI=1S/C17H11BrN4O4/c1-25-15-7-6-12(8-13(15)18)26-11-4-2-10(3-5-11)22-17(24)20-16(23)14(9-19)21-22/h2-8H,1H3,(H,20,23,24)