2-[2-[(3-ethynylphenoxy)methyl]morpholin-4-yl]carbonyl-3-(4-hydroxyphenyl)prop-2-enenitrile

Systemtic Name: 2-[2-[(3-ethynylphenoxy)methyl]morpholin-4-yl]carbonyl-3-(4-hydroxyphenyl)prop-2-enenitrile Openeye Name: 2-[2-[(3-ethynylphenoxy)methyl]morpholine-4-carbonyl]-3-(4-hydroxyphenyl)prop-2-enenitrile CAS Name: 2-[[2-[(3-ethynylphenoxy)methyl]-4-morpholinyl]-oxomethyl]-3-(4-hydroxyphenyl)-2-propenenitrile IUPAC Name: 2-[2-[(3-ethynylphenoxy)methyl]morpholine-4-carbonyl]-3-(4-hydroxyphenyl)prop-2-enenitrile Traditional Name: 2-[2-[(3-ethynylphenoxy)methyl]morpholine-4-carbonyl]-3-(4-hydroxyphenyl)acrylonitrile Formula: C23H20N2O4 MolecularWeight: 388.4159

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1=CC(=CC=C1)OCC2CN(CCO2)C(=O)C(=CC3=CC=C(C=C3)O)C#N

Isomeric SMILES

C#CC1=CC(=CC=C1)OCC2CN(CCO2)C(=O)C(=CC3=CC=C(C=C3)O)C#N

InChI

InChI=1S/C23H20N2O4/c1-2-17-4-3-5-21(13-17)29-16-22-15-25(10-11-28-22)23(27)19(14-24)12-18-6-8-20(26)9-7-18/h1,3-9,12-13,22,26H,10-11,15-16H2