2-[4-[(E)-2-(6-methoxy-1,3-benzothiazol-2-yl)ethenyl]phenoxy]ethanenitrile

Systemtic Name: 2-[4-[(E)-2-(6-methoxy-1,3-benzothiazol-2-yl)ethenyl]phenoxy]ethanenitrile Openeye Name: 2-[4-[(E)-2-(6-methoxy-1,3-benzothiazol-2-yl)vinyl]phenoxy]acetonitrile CAS Name: 2-[4-[(E)-2-(6-methoxy-1,3-benzothiazol-2-yl)ethenyl]phenoxy]acetonitrile IUPAC Name: 2-[4-[(E)-2-(6-methoxy-1,3-benzothiazol-2-yl)ethenyl]phenoxy]acetonitrile Traditional Name: 2-[4-[(E)-2-(6-methoxy-1,3-benzothiazol-2-yl)vinyl]phenoxy]acetonitrile Formula: C18H14N2O2S MolecularWeight: 322.38096

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(S2)C=CC3=CC=C(C=C3)OCC#N

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(S2)/C=C/C3=CC=C(C=C3)OCC#N

InChI

InChI=1S/C18H14N2O2S/c1-21-15-7-8-16-17(12-15)23-18(20-16)9-4-13-2-5-14(6-3-13)22-11-10-19/h2-9,12H,11H2,1H3/b9-4+