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

Systemtic Name: (E)-4-(4-tert-butylphenyl)-6-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-6-oxidanylidene-hex-4-enoic acid Openeye Name: (E)-4-(4-tert-butylphenyl)-6-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-6-oxo-hex-4-enoic acid CAS Name: (E)-4-(4-tert-butylphenyl)-6-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-6-oxo-4-hexenoic acid IUPAC Name: (E)-4-(4-tert-butylphenyl)-6-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-6-oxohex-4-enoic acid Traditional Name: (E)-4-(4-tert-butylphenyl)-6-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-6-keto-hex-4-enoic acid Formula: C24H27NO5 MolecularWeight: 409.47488

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=CC(=O)NC2=CC3=C(C=C2)OCCO3)CCC(=O)O

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)/C(=C/C(=O)NC2=CC3=C(C=C2)OCCO3)/CCC(=O)O

InChI

InChI=1S/C24H27NO5/c1-24(2,3)18-7-4-16(5-8-18)17(6-11-23(27)28)14-22(26)25-19-9-10-20-21(15-19)30-13-12-29-20/h4-5,7-10,14-15H,6,11-13H2,1-3H3,(H,25,26)(H,27,28)/b17-14+