4-(3-morpholin-4-ium-4-ylpropylamino)-4-oxidanylidene-but-2-enoate

Systemtic Name: 4-(3-morpholin-4-ium-4-ylpropylamino)-4-oxidanylidene-but-2-enoate Openeye Name: 4-(3-morpholin-4-ium-4-ylpropylamino)-4-oxo-but-2-enoate CAS Name: 4-[3-(4-morpholin-4-iumyl)propylamino]-4-oxo-2-butenoate IUPAC Name: 4-(3-morpholin-4-ium-4-ylpropylamino)-4-oxobut-2-enoate Traditional Name: 4-keto-4-(3-morpholin-4-ium-4-ylpropylamino)but-2-enoate Formula: C11H18N2O4 MolecularWeight: 242.27162

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCCNC(=O)C=CC(=O)[O-]

Isomeric SMILES

C1COCC[NH+]1CCCNC(=O)C=CC(=O)[O-]

InChI

InChI=1S/C11H18N2O4/c14-10(2-3-11(15)16)12-4-1-5-13-6-8-17-9-7-13/h2-3H,1,4-9H2,(H,12,14)(H,15,16)