[2-(3-methylbutan-2-ylamino)-2-oxidanylidene-ethyl] (E)-3-(1,3-benzodioxol-5-yl)prop-2-enoate

Systemtic Name: [2-(3-methylbutan-2-ylamino)-2-oxidanylidene-ethyl] (E)-3-(1,3-benzodioxol-5-yl)prop-2-enoate Openeye Name: [2-(1,2-dimethylpropylamino)-2-oxo-ethyl] (E)-3-(1,3-benzodioxol-5-yl)prop-2-enoate CAS Name: (E)-3-(1,3-benzodioxol-5-yl)-2-propenoic acid [2-(3-methylbutan-2-ylamino)-2-oxoethyl] ester IUPAC Name: [2-(3-methylbutan-2-ylamino)-2-oxoethyl] (E)-3-(1,3-benzodioxol-5-yl)prop-2-enoate Traditional Name: (E)-3-(1,3-benzodioxol-5-yl)acrylic acid [2-(1,2-dimethylpropylamino)-2-keto-ethyl] ester Formula: C17H21NO5 MolecularWeight: 319.35234

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C)NC(=O)COC(=O)C=CC1=CC2=C(C=C1)OCO2

Isomeric SMILES

CC(C)C(C)NC(=O)COC(=O)/C=C/C1=CC2=C(C=C1)OCO2

InChI

InChI=1S/C17H21NO5/c1-11(2)12(3)18-16(19)9-21-17(20)7-5-13-4-6-14-15(8-13)23-10-22-14/h4-8,11-12H,9-10H2,1-3H3,(H,18,19)/b7-5+