(2-benzamido-2-oxidanylidene-ethyl) 3-bromanyl-5-methoxy-4-propoxy-benzoate

Systemtic Name: (2-benzamido-2-oxidanylidene-ethyl) 3-bromanyl-5-methoxy-4-propoxy-benzoate Openeye Name: (2-benzamido-2-oxo-ethyl) 3-bromo-5-methoxy-4-propoxy-benzoate CAS Name: 3-bromo-5-methoxy-4-propoxybenzoic acid (2-benzamido-2-oxoethyl) ester IUPAC Name: (2-benzamido-2-oxoethyl) 3-bromo-5-methoxy-4-propoxybenzoate Traditional Name: 3-bromo-5-methoxy-4-propoxy-benzoic acid (2-benzamido-2-keto-ethyl) ester Formula: C20H20BrNO6 MolecularWeight: 450.2799

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1Br)C(=O)OCC(=O)NC(=O)C2=CC=CC=C2)OC

Isomeric SMILES

CCCOC1=C(C=C(C=C1Br)C(=O)OCC(=O)NC(=O)C2=CC=CC=C2)OC

InChI

InChI=1S/C20H20BrNO6/c1-3-9-27-18-15(21)10-14(11-16(18)26-2)20(25)28-12-17(23)22-19(24)13-7-5-4-6-8-13/h4-8,10-11H,3,9,12H2,1-2H3,(H,22,23,24)