(Z)-2-azanyl-4-(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)but-3-ene-1,1,3-tricarbonitrile

Systemtic Name: (Z)-2-azanyl-4-(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)but-3-ene-1,1,3-tricarbonitrile Openeye Name: (Z)-2-amino-4-(3-bromo-4-hydroxy-5-methoxy-phenyl)but-3-ene-1,1,3-tricarbonitrile CAS Name: (Z)-2-amino-4-(3-bromo-4-hydroxy-5-methoxyphenyl)-3-butene-1,1,3-tricarbonitrile IUPAC Name: (Z)-2-amino-4-(3-bromo-4-hydroxy-5-methoxyphenyl)but-3-ene-1,1,3-tricarbonitrile Traditional Name: (Z)-2-amino-4-(3-bromo-4-hydroxy-5-methoxy-phenyl)but-3-ene-1,1,3-tricarbonitrile Formula: C14H11BrN4O2 MolecularWeight: 347.16674

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=C(C#N)C(C(C#N)C#N)N)Br)O

Isomeric SMILES

COC1=C(C(=CC(=C1)/C=C(\C#N)/C(C(C#N)C#N)N)Br)O

InChI

InChI=1S/C14H11BrN4O2/c1-21-12-4-8(3-11(15)14(12)20)2-9(5-16)13(19)10(6-17)7-18/h2-4,10,13,20H,19H2,1H3/b9-2+