[2-[2-(2,4-dimethylphenoxy)ethylamino]-2-oxidanylidene-ethyl] (E)-3-thiophen-3-ylprop-2-enoate

Systemtic Name: [2-[2-(2,4-dimethylphenoxy)ethylamino]-2-oxidanylidene-ethyl] (E)-3-thiophen-3-ylprop-2-enoate Openeye Name: [2-[2-(2,4-dimethylphenoxy)ethylamino]-2-oxo-ethyl] (E)-3-(3-thienyl)prop-2-enoate CAS Name: (E)-3-(3-thiophenyl)-2-propenoic acid [2-[2-(2,4-dimethylphenoxy)ethylamino]-2-oxoethyl] ester IUPAC Name: [2-[2-(2,4-dimethylphenoxy)ethylamino]-2-oxoethyl] (E)-3-thiophen-3-ylprop-2-enoate Traditional Name: (E)-3-(3-thienyl)acrylic acid [2-[2-(2,4-dimethylphenoxy)ethylamino]-2-keto-ethyl] ester Formula: C19H21NO4S MolecularWeight: 359.43934

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCCNC(=O)COC(=O)C=CC2=CSC=C2)C

Isomeric SMILES

CC1=CC(=C(C=C1)OCCNC(=O)COC(=O)/C=C/C2=CSC=C2)C

InChI

InChI=1S/C19H21NO4S/c1-14-3-5-17(15(2)11-14)23-9-8-20-18(21)12-24-19(22)6-4-16-7-10-25-13-16/h3-7,10-11,13H,8-9,12H2,1-2H3,(H,20,21)/b6-4+