(E)-4-[3-(dimethylazaniumyl)propylcarbamoylamino]-4-oxidanylidene-but-2-enoate

Systemtic Name: (E)-4-[3-(dimethylazaniumyl)propylcarbamoylamino]-4-oxidanylidene-but-2-enoate Openeye Name: (E)-4-[3-(dimethylammonio)propylcarbamoylamino]-4-oxo-but-2-enoate CAS Name: (E)-4-[[[3-(dimethylammonio)propylamino]-oxomethyl]amino]-4-oxo-2-butenoate IUPAC Name: (E)-4-[3-(dimethylazaniumyl)propylcarbamoylamino]-4-oxobut-2-enoate Traditional Name: (E)-4-[3-(dimethylammonio)propylcarbamoylamino]-4-keto-but-2-enoate Formula: C10H17N3O4 MolecularWeight: 243.25968

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCNC(=O)NC(=O)C=CC(=O)[O-]

Isomeric SMILES

C[NH+](C)CCCNC(=O)NC(=O)/C=C/C(=O)[O-]

InChI

InChI=1S/C10H17N3O4/c1-13(2)7-3-6-11-10(17)12-8(14)4-5-9(15)16/h4-5H,3,6-7H2,1-2H3,(H,15,16)(H2,11,12,14,17)/b5-4+