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

Systemtic Name: 2,2-dibutyl-4-[[(Z)-2-ethoxy-3-(3-oxidanylideneprop-2-enoxy)prop-2-enyl]amino]-3-oxidanyl-3,4-dihydrochromene-6-carbonitrile Openeye Name: 2,2-dibutyl-4-[[(Z)-2-ethoxy-3-(3-oxoallyloxy)allyl]amino]-3-hydroxy-chromane-6-carbonitrile CAS Name: 2,2-dibutyl-4-[[(Z)-2-ethoxy-3-(3-oxoprop-2-enoxy)prop-2-enyl]amino]-3-hydroxy-3,4-dihydro-2H-1-benzopyran-6-carbonitrile IUPAC Name: 2,2-dibutyl-4-[[(Z)-2-ethoxy-3-(3-oxoprop-2-enoxy)prop-2-enyl]amino]-3-hydroxy-3,4-dihydrochromene-6-carbonitrile Traditional Name: 2,2-dibutyl-4-[[(Z)-2-ethoxy-3-(3-ketoallyloxy)allyl]amino]-3-hydroxy-chroman-6-carbonitrile Formula: C26H36N2O5 MolecularWeight: 456.57444

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(C(C(C2=C(O1)C=CC(=C2)C#N)NCC(=COCC=C=O)OCC)O)CCCC

Isomeric SMILES

CCCCC1(C(C(C2=C(O1)C=CC(=C2)C#N)NC/C(=C/OCC=C=O)/OCC)O)CCCC

InChI

InChI=1S/C26H36N2O5/c1-4-7-12-26(13-8-5-2)25(30)24(22-16-20(17-27)10-11-23(22)33-26)28-18-21(32-6-3)19-31-15-9-14-29/h9-11,16,19,24-25,28,30H,4-8,12-13,15,18H2,1-3H3/b21-19-