2-[2-bromanyl-6-methoxy-4-[(Z)-(3-oxidanylidene-1-benzothiophen-2-ylidene)methyl]phenoxy]ethanenitrile

Systemtic Name: 2-[2-bromanyl-6-methoxy-4-[(Z)-(3-oxidanylidene-1-benzothiophen-2-ylidene)methyl]phenoxy]ethanenitrile Openeye Name: 2-[2-bromo-6-methoxy-4-[(Z)-(3-oxobenzothiophen-2-ylidene)methyl]phenoxy]acetonitrile CAS Name: 2-[2-bromo-6-methoxy-4-[(Z)-(3-oxo-1-benzothiophen-2-ylidene)methyl]phenoxy]acetonitrile IUPAC Name: 2-[2-bromo-6-methoxy-4-[(Z)-(3-oxo-1-benzothiophen-2-ylidene)methyl]phenoxy]acetonitrile Traditional Name: 2-[2-bromo-4-[(Z)-(3-ketobenzothiophen-2-ylidene)methyl]-6-methoxy-phenoxy]acetonitrile Formula: C18H12BrNO3S MolecularWeight: 402.26178

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=C2C(=O)C3=CC=CC=C3S2)Br)OCC#N

Isomeric SMILES

COC1=C(C(=CC(=C1)/C=C\2/C(=O)C3=CC=CC=C3S2)Br)OCC#N

InChI

InChI=1S/C18H12BrNO3S/c1-22-14-9-11(8-13(19)18(14)23-7-6-20)10-16-17(21)12-4-2-3-5-15(12)24-16/h2-5,8-10H,7H2,1H3/b16-10-