methyl 4-[(E)-3-(2,3-dihydro-1,4-benzodioxin-3-ylmethylamino)-3-oxidanylidene-prop-1-enyl]benzoate

Systemtic Name: methyl 4-[(E)-3-(2,3-dihydro-1,4-benzodioxin-3-ylmethylamino)-3-oxidanylidene-prop-1-enyl]benzoate Openeye Name: methyl 4-[(E)-3-(2,3-dihydro-1,4-benzodioxin-3-ylmethylamino)-3-oxo-prop-1-enyl]benzoate CAS Name: 4-[(E)-3-(2,3-dihydro-1,4-benzodioxin-3-ylmethylamino)-3-oxoprop-1-enyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(E)-3-(2,3-dihydro-1,4-benzodioxin-3-ylmethylamino)-3-oxoprop-1-enyl]benzoate Traditional Name: 4-[(E)-3-(2,3-dihydro-1,4-benzodioxin-3-ylmethylamino)-3-keto-prop-1-enyl]benzoic acid methyl ester Formula: C20H19NO5 MolecularWeight: 353.36856

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C=CC(=O)NCC2COC3=CC=CC=C3O2

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)/C=C/C(=O)NCC2COC3=CC=CC=C3O2

InChI

InChI=1S/C20H19NO5/c1-24-20(23)15-9-6-14(7-10-15)8-11-19(22)21-12-16-13-25-17-4-2-3-5-18(17)26-16/h2-11,16H,12-13H2,1H3,(H,21,22)/b11-8+