4-[3-(diethylazaniumyl)propylamino]-4-oxidanylidene-but-2-enoate

Systemtic Name: 4-[3-(diethylazaniumyl)propylamino]-4-oxidanylidene-but-2-enoate Openeye Name: 4-[3-(diethylammonio)propylamino]-4-oxo-but-2-enoate CAS Name: 4-[3-(diethylammonio)propylamino]-4-oxo-2-butenoate IUPAC Name: 4-[3-(diethylazaniumyl)propylamino]-4-oxobut-2-enoate Traditional Name: 4-[3-(diethylammonio)propylamino]-4-keto-but-2-enoate Formula: C11H20N2O3 MolecularWeight: 228.2881

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H20N2O3/c1-3-13(4-2)9-5-8-12-10(14)6-7-11(15)16/h6-7H,3-5,8-9H2,1-2H3,(H,12,14)(H,15,16)