[1-[(3,5-dimethoxyphenyl)amino]-1-oxidanylidene-propan-2-yl] 4-butylbenzoate

Systemtic Name: [1-[(3,5-dimethoxyphenyl)amino]-1-oxidanylidene-propan-2-yl] 4-butylbenzoate Openeye Name: [2-(3,5-dimethoxyanilino)-1-methyl-2-oxo-ethyl] 4-butylbenzoate CAS Name: 4-butylbenzoic acid [1-(3,5-dimethoxyanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(3,5-dimethoxyanilino)-1-oxopropan-2-yl] 4-butylbenzoate Traditional Name: 4-butylbenzoic acid [2-(3,5-dimethoxyanilino)-2-keto-1-methyl-ethyl] ester Formula: C22H27NO5 MolecularWeight: 385.45348

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C(=O)OC(C)C(=O)NC2=CC(=CC(=C2)OC)OC

Isomeric SMILES

CCCCC1=CC=C(C=C1)C(=O)OC(C)C(=O)NC2=CC(=CC(=C2)OC)OC

InChI

InChI=1S/C22H27NO5/c1-5-6-7-16-8-10-17(11-9-16)22(25)28-15(2)21(24)23-18-12-19(26-3)14-20(13-18)27-4/h8-15H,5-7H2,1-4H3,(H,23,24)