2-[2-(2-methylprop-2-enoylamino)ethylcarbamoylamino]benzoic acid

Systemtic Name: 2-[2-(2-methylprop-2-enoylamino)ethylcarbamoylamino]benzoic acid Openeye Name: 2-[2-(2-methylprop-2-enoylamino)ethylcarbamoylamino]benzoic acid CAS Name: 2-[[[2-[(2-methyl-1-oxoprop-2-enyl)amino]ethylamino]-oxomethyl]amino]benzoic acid IUPAC Name: 2-[2-(2-methylprop-2-enoylamino)ethylcarbamoylamino]benzoic acid Traditional Name: 2-(2-methacrylamidoethylcarbamoylamino)benzoic acid Formula: C14H17N3O4 MolecularWeight: 291.30248

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C(=O)NCCNC(=O)NC1=CC=CC=C1C(=O)O

Isomeric SMILES

CC(=C)C(=O)NCCNC(=O)NC1=CC=CC=C1C(=O)O

InChI

InChI=1S/C14H17N3O4/c1-9(2)12(18)15-7-8-16-14(21)17-11-6-4-3-5-10(11)13(19)20/h3-6H,1,7-8H2,2H3,(H,15,18)(H,19,20)(H2,16,17,21)