(E)-3-(3-bromanyl-5-ethoxy-4-methoxy-phenyl)-2-thiophen-2-ylcarbonyl-prop-2-enenitrile

Systemtic Name: (E)-3-(3-bromanyl-5-ethoxy-4-methoxy-phenyl)-2-thiophen-2-ylcarbonyl-prop-2-enenitrile Openeye Name: (E)-3-(3-bromo-5-ethoxy-4-methoxy-phenyl)-2-(thiophene-2-carbonyl)prop-2-enenitrile CAS Name: (E)-3-(3-bromo-5-ethoxy-4-methoxyphenyl)-2-[oxo(thiophen-2-yl)methyl]-2-propenenitrile IUPAC Name: (E)-3-(3-bromo-5-ethoxy-4-methoxyphenyl)-2-(thiophene-2-carbonyl)prop-2-enenitrile Traditional Name: (E)-3-(3-bromo-5-ethoxy-4-methoxy-phenyl)-2-(2-thenoyl)acrylonitrile Formula: C17H14BrNO3S MolecularWeight: 392.26696

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C=C(C#N)C(=O)C2=CC=CS2)Br)OC

Isomeric SMILES

CCOC1=C(C(=CC(=C1)/C=C(\C#N)/C(=O)C2=CC=CS2)Br)OC

InChI

InChI=1S/C17H14BrNO3S/c1-3-22-14-9-11(8-13(18)17(14)21-2)7-12(10-19)16(20)15-5-4-6-23-15/h4-9H,3H2,1-2H3/b12-7+