(E)-4-[3-(diethylamino)propylcarbamoylamino]-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (E)-4-[3-(diethylamino)propylcarbamoylamino]-4-oxidanylidene-but-2-enoic acid Openeye Name: (E)-4-[3-(diethylamino)propylcarbamoylamino]-4-oxo-but-2-enoic acid CAS Name: (E)-4-[[[3-(diethylamino)propylamino]-oxomethyl]amino]-4-oxo-2-butenoic acid IUPAC Name: (E)-4-[3-(diethylamino)propylcarbamoylamino]-4-oxobut-2-enoic acid Traditional Name: (E)-4-[3-(diethylamino)propylcarbamoylamino]-4-keto-but-2-enoic acid Formula: C12H21N3O4 MolecularWeight: 271.31284

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCNC(=O)NC(=O)C=CC(=O)O

Isomeric SMILES

CCN(CC)CCCNC(=O)NC(=O)/C=C/C(=O)O

InChI

InChI=1S/C12H21N3O4/c1-3-15(4-2)9-5-8-13-12(19)14-10(16)6-7-11(17)18/h6-7H,3-5,8-9H2,1-2H3,(H,17,18)(H2,13,14,16,19)/b7-6+