[2-(butylamino)-2-oxidanylidene-ethyl] 2-(2,5-dimethylphenyl)carbonylbenzoate

Systemtic Name: [2-(butylamino)-2-oxidanylidene-ethyl] 2-(2,5-dimethylphenyl)carbonylbenzoate Openeye Name: [2-(butylamino)-2-oxo-ethyl] 2-(2,5-dimethylbenzoyl)benzoate CAS Name: 2-[(2,5-dimethylphenyl)-oxomethyl]benzoic acid [2-(butylamino)-2-oxoethyl] ester IUPAC Name: [2-(butylamino)-2-oxoethyl] 2-(2,5-dimethylbenzoyl)benzoate Traditional Name: 2-(2,5-dimethylbenzoyl)benzoic acid [2-(butylamino)-2-keto-ethyl] ester Formula: C22H25NO4 MolecularWeight: 367.4382

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)COC(=O)C1=CC=CC=C1C(=O)C2=C(C=CC(=C2)C)C

Isomeric SMILES

CCCCNC(=O)COC(=O)C1=CC=CC=C1C(=O)C2=C(C=CC(=C2)C)C

InChI

InChI=1S/C22H25NO4/c1-4-5-12-23-20(24)14-27-22(26)18-9-7-6-8-17(18)21(25)19-13-15(2)10-11-16(19)3/h6-11,13H,4-5,12,14H2,1-3H3,(H,23,24)