[2-[2-cyanoethyl(methyl)amino]-2-oxidanylidene-ethyl] 3-(1,3-benzodioxol-5-yl)prop-2-enoate

Systemtic Name: [2-[2-cyanoethyl(methyl)amino]-2-oxidanylidene-ethyl] 3-(1,3-benzodioxol-5-yl)prop-2-enoate Openeye Name: [2-[2-cyanoethyl(methyl)amino]-2-oxo-ethyl] 3-(1,3-benzodioxol-5-yl)prop-2-enoate CAS Name: 3-(1,3-benzodioxol-5-yl)-2-propenoic acid [2-[2-cyanoethyl(methyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[2-cyanoethyl(methyl)amino]-2-oxoethyl] 3-(1,3-benzodioxol-5-yl)prop-2-enoate Traditional Name: 3-(1,3-benzodioxol-5-yl)acrylic acid [2-[2-cyanoethyl(methyl)amino]-2-keto-ethyl] ester Formula: C16H16N2O5 MolecularWeight: 316.30864

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC#N)C(=O)COC(=O)C=CC1=CC2=C(C=C1)OCO2

Isomeric SMILES

CN(CCC#N)C(=O)COC(=O)C=CC1=CC2=C(C=C1)OCO2

InChI

InChI=1S/C16H16N2O5/c1-18(8-2-7-17)15(19)10-21-16(20)6-4-12-3-5-13-14(9-12)23-11-22-13/h3-6,9H,2,8,10-11H2,1H3