[2-(aminocarbonylamino)-2-oxidanylidene-ethyl] (E)-3-(7-chloranyl-1,3-benzodioxol-5-yl)prop-2-enoate

Systemtic Name: [2-(aminocarbonylamino)-2-oxidanylidene-ethyl] (E)-3-(7-chloranyl-1,3-benzodioxol-5-yl)prop-2-enoate Openeye Name: (2-oxo-2-ureido-ethyl) (E)-3-(7-chloro-1,3-benzodioxol-5-yl)prop-2-enoate CAS Name: (E)-3-(7-chloro-1,3-benzodioxol-5-yl)-2-propenoic acid [2-(carbamoylamino)-2-oxoethyl] ester IUPAC Name: [2-(carbamoylamino)-2-oxoethyl] (E)-3-(7-chloro-1,3-benzodioxol-5-yl)prop-2-enoate Traditional Name: (E)-3-(7-chloro-1,3-benzodioxol-5-yl)acrylic acid (2-keto-2-ureido-ethyl) ester Formula: C13H11ClN2O6 MolecularWeight: 326.68924

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C(=CC(=C2)C=CC(=O)OCC(=O)NC(=O)N)Cl

Isomeric SMILES

C1OC2=C(O1)C(=CC(=C2)/C=C/C(=O)OCC(=O)NC(=O)N)Cl

InChI

InChI=1S/C13H11ClN2O6/c14-8-3-7(4-9-12(8)22-6-21-9)1-2-11(18)20-5-10(17)16-13(15)19/h1-4H,5-6H2,(H3,15,16,17,19)/b2-1+