2-[4-[[(E)-2-(1,3-benzothiazol-2-yl)ethenyl]-methyl-amino]phenyl]ethanoate

Systemtic Name: 2-[4-[[(E)-2-(1,3-benzothiazol-2-yl)ethenyl]-methyl-amino]phenyl]ethanoate Openeye Name: 2-[4-[[(E)-2-(1,3-benzothiazol-2-yl)vinyl]-methyl-amino]phenyl]acetate CAS Name: 2-[4-[[(E)-2-(1,3-benzothiazol-2-yl)ethenyl]-methylamino]phenyl]acetate IUPAC Name: 2-[4-[[(E)-2-(1,3-benzothiazol-2-yl)ethenyl]-methylamino]phenyl]acetate Traditional Name: 2-[4-[[(E)-2-(1,3-benzothiazol-2-yl)vinyl]-methyl-amino]phenyl]acetate Formula: C18H15N2O2S- MolecularWeight: 323.3889

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Descriptors Computed from Structure

Canonical SMILES:

CN(C=CC1=NC2=CC=CC=C2S1)C3=CC=C(C=C3)CC(=O)[O-]

Isomeric SMILES

CN(/C=C/C1=NC2=CC=CC=C2S1)C3=CC=C(C=C3)CC(=O)[O-]

InChI

InChI=1S/C18H16N2O2S/c1-20(14-8-6-13(7-9-14)12-18(21)22)11-10-17-19-15-4-2-3-5-16(15)23-17/h2-11H,12H2,1H3,(H,21,22)/p-1/b11-10+