[2-(2,2-diphenylethylamino)-2-oxidanylidene-ethyl] 3-chloranyl-4,5-dimethoxy-benzoate

Systemtic Name: [2-(2,2-diphenylethylamino)-2-oxidanylidene-ethyl] 3-chloranyl-4,5-dimethoxy-benzoate Openeye Name: [2-(2,2-diphenylethylamino)-2-oxo-ethyl] 3-chloro-4,5-dimethoxy-benzoate CAS Name: 3-chloro-4,5-dimethoxybenzoic acid [2-(2,2-diphenylethylamino)-2-oxoethyl] ester IUPAC Name: [2-(2,2-diphenylethylamino)-2-oxoethyl] 3-chloro-4,5-dimethoxybenzoate Traditional Name: 3-chloro-4,5-dimethoxy-benzoic acid [2-(2,2-diphenylethylamino)-2-keto-ethyl] ester Formula: C25H24ClNO5 MolecularWeight: 453.91476

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C(=O)OCC(=O)NCC(C2=CC=CC=C2)C3=CC=CC=C3)Cl)OC

Isomeric SMILES

COC1=C(C(=CC(=C1)C(=O)OCC(=O)NCC(C2=CC=CC=C2)C3=CC=CC=C3)Cl)OC

InChI

InChI=1S/C25H24ClNO5/c1-30-22-14-19(13-21(26)24(22)31-2)25(29)32-16-23(28)27-15-20(17-9-5-3-6-10-17)18-11-7-4-8-12-18/h3-14,20H,15-16H2,1-2H3,(H,27,28)