(Z)-2-(1,3-benzoxazol-2-ylsulfanyl)-3-[4-(diethylamino)-2-oxidanyl-phenyl]prop-2-enoate

Systemtic Name: (Z)-2-(1,3-benzoxazol-2-ylsulfanyl)-3-[4-(diethylamino)-2-oxidanyl-phenyl]prop-2-enoate Openeye Name: (Z)-2-(1,3-benzoxazol-2-ylsulfanyl)-3-[4-(diethylamino)-2-hydroxy-phenyl]prop-2-enoate CAS Name: (Z)-2-(1,3-benzoxazol-2-ylthio)-3-[4-(diethylamino)-2-hydroxyphenyl]-2-propenoate IUPAC Name: (Z)-2-(1,3-benzoxazol-2-ylsulfanyl)-3-[4-(diethylamino)-2-hydroxyphenyl]prop-2-enoate Traditional Name: (Z)-2-(1,3-benzoxazol-2-ylthio)-3-[4-(diethylamino)-2-hydroxy-phenyl]acrylate Formula: C20H19N2O4S- MolecularWeight: 383.44086

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC(=C(C=C1)C=C(C(=O)[O-])SC2=NC3=CC=CC=C3O2)O

Isomeric SMILES

CCN(CC)C1=CC(=C(C=C1)/C=C(/C(=O)[O-])\SC2=NC3=CC=CC=C3O2)O

InChI

InChI=1S/C20H20N2O4S/c1-3-22(4-2)14-10-9-13(16(23)12-14)11-18(19(24)25)27-20-21-15-7-5-6-8-17(15)26-20/h5-12,23H,3-4H2,1-2H3,(H,24,25)/p-1/b18-11-