4-[[(Z)-2-ethoxy-3-(3-oxidanylideneprop-2-enoxy)prop-2-enyl]amino]-2,2-diethyl-3-oxidanyl-3,4-dihydrochromene-6-carbonitrile

Systemtic Name: 4-[[(Z)-2-ethoxy-3-(3-oxidanylideneprop-2-enoxy)prop-2-enyl]amino]-2,2-diethyl-3-oxidanyl-3,4-dihydrochromene-6-carbonitrile Openeye Name: 4-[[(Z)-2-ethoxy-3-(3-oxoallyloxy)allyl]amino]-2,2-diethyl-3-hydroxy-chromane-6-carbonitrile CAS Name: 4-[[(Z)-2-ethoxy-3-(3-oxoprop-2-enoxy)prop-2-enyl]amino]-2,2-diethyl-3-hydroxy-3,4-dihydro-2H-1-benzopyran-6-carbonitrile IUPAC Name: 4-[[(Z)-2-ethoxy-3-(3-oxoprop-2-enoxy)prop-2-enyl]amino]-2,2-diethyl-3-hydroxy-3,4-dihydrochromene-6-carbonitrile Traditional Name: 4-[[(Z)-2-ethoxy-3-(3-ketoallyloxy)allyl]amino]-2,2-diethyl-3-hydroxy-chroman-6-carbonitrile Formula: C22H28N2O5 MolecularWeight: 400.46812

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C(C(C2=C(O1)C=CC(=C2)C#N)NCC(=COCC=C=O)OCC)O)CC

Isomeric SMILES

CCC1(C(C(C2=C(O1)C=CC(=C2)C#N)NC/C(=C/OCC=C=O)/OCC)O)CC

InChI

InChI=1S/C22H28N2O5/c1-4-22(5-2)21(26)20(18-12-16(13-23)8-9-19(18)29-22)24-14-17(28-6-3)15-27-11-7-10-25/h7-9,12,15,20-21,24,26H,4-6,11,14H2,1-3H3/b17-15-