potassium ethyl (E)-3-(5-bromanyl-4-methoxy-2-nitro-phenyl)-2-oxidanyl-prop-2-enoate

Systemtic Name: potassium ethyl (E)-3-(5-bromanyl-4-methoxy-2-nitro-phenyl)-2-oxidanyl-prop-2-enoate Openeye Name: potassium ethyl (E)-3-(5-bromo-4-methoxy-2-nitro-phenyl)-2-hydroxy-prop-2-enoate CAS Name: potassium (E)-3-(5-bromo-4-methoxy-2-nitrophenyl)-2-hydroxy-2-propenoic acid ethyl ester IUPAC Name: potassium ethyl (E)-3-(5-bromo-4-methoxy-2-nitrophenyl)-2-hydroxyprop-2-enoate Traditional Name: potassium (E)-3-(5-bromo-4-methoxy-2-nitro-phenyl)-2-hydroxy-acrylic acid ethyl ester Formula: C12H12BrKNO6+ MolecularWeight: 385.22908

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CC1=CC(=C(C=C1[N+](=O)[O-])OC)Br)O.[K+]

Isomeric SMILES

CCOC(=O)/C(=C\C1=CC(=C(C=C1[N+](=O)[O-])OC)Br)/O.[K+]

InChI

InChI=1S/C12H12BrNO6.K/c1-3-20-12(16)10(15)5-7-4-8(13)11(19-2)6-9(7)14(17)18;/h4-6,15H,3H2,1-2H3;/q;+1/b10-5+;