ethyl (E)-4-(4-tert-butylphenyl)-6-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-6-oxidanylidene-hex-4-enoate

Systemtic Name: ethyl (E)-4-(4-tert-butylphenyl)-6-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-6-oxidanylidene-hex-4-enoate Openeye Name: ethyl (E)-4-(4-tert-butylphenyl)-6-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-6-oxo-hex-4-enoate CAS Name: (E)-4-(4-tert-butylphenyl)-6-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-6-oxo-4-hexenoic acid ethyl ester IUPAC Name: ethyl (E)-4-(4-tert-butylphenyl)-6-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-6-oxohex-4-enoate Traditional Name: (E)-4-(4-tert-butylphenyl)-6-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-6-keto-hex-4-enoic acid ethyl ester Formula: C26H31NO5 MolecularWeight: 437.52804

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(=CC(=O)NC1=CC2=C(C=C1)OCCO2)C3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CCOC(=O)CC/C(=C\C(=O)NC1=CC2=C(C=C1)OCCO2)/C3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C26H31NO5/c1-5-30-25(29)13-8-19(18-6-9-20(10-7-18)26(2,3)4)16-24(28)27-21-11-12-22-23(17-21)32-15-14-31-22/h6-7,9-12,16-17H,5,8,13-15H2,1-4H3,(H,27,28)/b19-16+