[2-(naphthalen-1-ylamino)-2-oxidanylidene-ethyl] 2,6-bis(bromanyl)-3,4,5-trimethoxy-benzoate

Systemtic Name: [2-(naphthalen-1-ylamino)-2-oxidanylidene-ethyl] 2,6-bis(bromanyl)-3,4,5-trimethoxy-benzoate Openeye Name: [2-(1-naphthylamino)-2-oxo-ethyl] 2,6-dibromo-3,4,5-trimethoxy-benzoate CAS Name: 2,6-dibromo-3,4,5-trimethoxybenzoic acid [2-(1-naphthalenylamino)-2-oxoethyl] ester IUPAC Name: [2-(naphthalen-1-ylamino)-2-oxoethyl] 2,6-dibromo-3,4,5-trimethoxybenzoate Traditional Name: 2,6-dibromo-3,4,5-trimethoxy-benzoic acid [2-keto-2-(1-naphthylamino)ethyl] ester Formula: C22H19Br2NO6 MolecularWeight: 553.19736

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C(=C1OC)Br)C(=O)OCC(=O)NC2=CC=CC3=CC=CC=C32)Br)OC

Isomeric SMILES

COC1=C(C(=C(C(=C1OC)Br)C(=O)OCC(=O)NC2=CC=CC3=CC=CC=C32)Br)OC

InChI

InChI=1S/C22H19Br2NO6/c1-28-19-17(23)16(18(24)20(29-2)21(19)30-3)22(27)31-11-15(26)25-14-10-6-8-12-7-4-5-9-13(12)14/h4-10H,11H2,1-3H3,(H,25,26)