[2-(1,3-benzodioxol-5-ylamino)-2-oxidanylidene-ethyl] 2-[[(E)-3-phenylprop-2-enoyl]amino]ethanoate

Systemtic Name: [2-(1,3-benzodioxol-5-ylamino)-2-oxidanylidene-ethyl] 2-[[(E)-3-phenylprop-2-enoyl]amino]ethanoate Openeye Name: [2-(1,3-benzodioxol-5-ylamino)-2-oxo-ethyl] 2-[[(E)-3-phenylprop-2-enoyl]amino]acetate CAS Name: 2-[[(E)-1-oxo-3-phenylprop-2-enyl]amino]acetic acid [2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl] ester IUPAC Name: [2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl] 2-[[(E)-3-phenylprop-2-enoyl]amino]acetate Traditional Name: 2-[[(E)-3-phenylacryloyl]amino]acetic acid [2-(1,3-benzodioxol-5-ylamino)-2-keto-ethyl] ester Formula: C20H18N2O6 MolecularWeight: 382.36672

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)NC(=O)COC(=O)CNC(=O)C=CC3=CC=CC=C3

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)NC(=O)COC(=O)CNC(=O)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C20H18N2O6/c23-18(9-6-14-4-2-1-3-5-14)21-11-20(25)26-12-19(24)22-15-7-8-16-17(10-15)28-13-27-16/h1-10H,11-13H2,(H,21,23)(H,22,24)/b9-6+