ethyl (E)-2-cyano-3-(6,6-dimethyl-5-morpholin-4-ium-4-yl-2,3-dihydropyran-4-yl)prop-2-enoate

Systemtic Name: ethyl (E)-2-cyano-3-(6,6-dimethyl-5-morpholin-4-ium-4-yl-2,3-dihydropyran-4-yl)prop-2-enoate Openeye Name: ethyl (E)-2-cyano-3-(6,6-dimethyl-5-morpholin-4-ium-4-yl-2,3-dihydropyran-4-yl)prop-2-enoate CAS Name: (E)-2-cyano-3-[6,6-dimethyl-5-(4-morpholin-4-iumyl)-2,3-dihydropyran-4-yl]-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-2-cyano-3-(6,6-dimethyl-5-morpholin-4-ium-4-yl-2,3-dihydropyran-4-yl)prop-2-enoate Traditional Name: (E)-2-cyano-3-(6,6-dimethyl-5-morpholin-4-ium-4-yl-2,3-dihydropyran-4-yl)acrylic acid ethyl ester Formula: C17H25N2O4+ MolecularWeight: 321.3914

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CC1=C(C(OCC1)(C)C)[NH+]2CCOCC2)C#N

Isomeric SMILES

CCOC(=O)/C(=C/C1=C(C(OCC1)(C)C)[NH+]2CCOCC2)/C#N

InChI

InChI=1S/C17H24N2O4/c1-4-22-16(20)14(12-18)11-13-5-8-23-17(2,3)15(13)19-6-9-21-10-7-19/h11H,4-10H2,1-3H3/p+1/b14-11+