N-(2-hydroxyphenyl)-1-[2-oxidanylidene-2-(prop-2-enylcarbamoylamino)ethyl]piperidin-1-ium-4-carboxamide

Systemtic Name: N-(2-hydroxyphenyl)-1-[2-oxidanylidene-2-(prop-2-enylcarbamoylamino)ethyl]piperidin-1-ium-4-carboxamide Openeye Name: 1-[2-(allylcarbamoylamino)-2-oxo-ethyl]-N-(2-hydroxyphenyl)piperidin-1-ium-4-carboxamide CAS Name: N-(2-hydroxyphenyl)-1-[2-oxo-2-[[oxo-(prop-2-enylamino)methyl]amino]ethyl]-4-piperidin-1-iumcarboxamide IUPAC Name: N-(2-hydroxyphenyl)-1-[2-oxo-2-(prop-2-enylcarbamoylamino)ethyl]piperidin-1-ium-4-carboxamide Traditional Name: 1-[2-(allylcarbamoylamino)-2-keto-ethyl]-N-(2-hydroxyphenyl)piperidin-1-ium-4-carboxamide Formula: C18H25N4O4+ MolecularWeight: 361.4155

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=O)NC(=O)C[NH+]1CCC(CC1)C(=O)NC2=CC=CC=C2O

Isomeric SMILES

C=CCNC(=O)NC(=O)C[NH+]1CCC(CC1)C(=O)NC2=CC=CC=C2O

InChI

InChI=1S/C18H24N4O4/c1-2-9-19-18(26)21-16(24)12-22-10-7-13(8-11-22)17(25)20-14-5-3-4-6-15(14)23/h2-6,13,23H,1,7-12H2,(H,20,25)(H2,19,21,24,26)/p+1