(Z)-2-cyano-3-(3-methoxy-2-oxidanyl-phenyl)-N-(2-morpholin-4-ium-4-ylethyl)prop-2-enamide

Systemtic Name: (Z)-2-cyano-3-(3-methoxy-2-oxidanyl-phenyl)-N-(2-morpholin-4-ium-4-ylethyl)prop-2-enamide Openeye Name: (Z)-2-cyano-3-(2-hydroxy-3-methoxy-phenyl)-N-(2-morpholin-4-ium-4-ylethyl)prop-2-enamide CAS Name: (Z)-2-cyano-3-(2-hydroxy-3-methoxyphenyl)-N-[2-(4-morpholin-4-iumyl)ethyl]-2-propenamide IUPAC Name: (Z)-2-cyano-3-(2-hydroxy-3-methoxyphenyl)-N-(2-morpholin-4-ium-4-ylethyl)prop-2-enamide Traditional Name: (Z)-2-cyano-3-(2-hydroxy-3-methoxy-phenyl)-N-(2-morpholin-4-ium-4-ylethyl)acrylamide Formula: C17H22N3O4+ MolecularWeight: 332.37428

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1O)C=C(C#N)C(=O)NCC[NH+]2CCOCC2

Isomeric SMILES

COC1=CC=CC(=C1O)/C=C(/C#N)\C(=O)NCC[NH+]2CCOCC2

InChI

InChI=1S/C17H21N3O4/c1-23-15-4-2-3-13(16(15)21)11-14(12-18)17(22)19-5-6-20-7-9-24-10-8-20/h2-4,11,21H,5-10H2,1H3,(H,19,22)/p+1/b14-11-