methyl N-[[2-(methoxycarbonylcarbamoylamino)phenyl]carbamoyl]carbamate; prop-2-enoic acid

Systemtic Name: methyl N-[[2-(methoxycarbonylcarbamoylamino)phenyl]carbamoyl]carbamate; prop-2-enoic acid Openeye Name: acrylic acid; methyl N-[[2-(methoxycarbonylcarbamoylamino)phenyl]carbamoyl]carbamate CAS Name: N-[[2-[[(methoxycarbonylamino)-oxomethyl]amino]anilino]-oxomethyl]carbamic acid methyl ester; 2-propenoic acid IUPAC Name: methyl N-[[2-(methoxycarbonylcarbamoylamino)phenyl]carbamoyl]carbamate; prop-2-enoic acid Traditional Name: acrylic acid; N-[[2-(carbomethoxycarbamoylamino)phenyl]carbamoyl]carbamic acid methyl ester Formula: C15H18N4O8 MolecularWeight: 382.32542

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)NC(=O)NC1=CC=CC=C1NC(=O)NC(=O)OC.C=CC(=O)O

Isomeric SMILES

COC(=O)NC(=O)NC1=CC=CC=C1NC(=O)NC(=O)OC.C=CC(=O)O

InChI

InChI=1S/C12H14N4O6.C3H4O2/c1-21-11(19)15-9(17)13-7-5-3-4-6-8(7)14-10(18)16-12(20)22-2;1-2-3(4)5/h3-6H,1-2H3,(H2,13,15,17,19)(H2,14,16,18,20);2H,1H2,(H,4,5)