(E)-4-(3-morpholin-4-ylpropylcarbamoylamino)-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (E)-4-(3-morpholin-4-ylpropylcarbamoylamino)-4-oxidanylidene-but-2-enoic acid Openeye Name: (E)-4-(3-morpholinopropylcarbamoylamino)-4-oxo-but-2-enoic acid CAS Name: (E)-4-[[[3-(4-morpholinyl)propylamino]-oxomethyl]amino]-4-oxo-2-butenoic acid IUPAC Name: (E)-4-(3-morpholin-4-ylpropylcarbamoylamino)-4-oxobut-2-enoic acid Traditional Name: (E)-4-keto-4-(3-morpholinopropylcarbamoylamino)but-2-enoic acid Formula: C12H19N3O5 MolecularWeight: 285.29636

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCCNC(=O)NC(=O)C=CC(=O)O

Isomeric SMILES

C1COCCN1CCCNC(=O)NC(=O)/C=C/C(=O)O

InChI

InChI=1S/C12H19N3O5/c16-10(2-3-11(17)18)14-12(19)13-4-1-5-15-6-8-20-9-7-15/h2-3H,1,4-9H2,(H,17,18)(H2,13,14,16,19)/b3-2+