[2-acetyloxy-5-[2-(tert-butylamino)ethanoyl]phenyl] 4-methylbenzoate hydrochloride

Systemtic Name: [2-acetyloxy-5-[2-(tert-butylamino)ethanoyl]phenyl] 4-methylbenzoate hydrochloride Openeye Name: [2-acetoxy-5-[2-(tert-butylamino)acetyl]phenyl] 4-methylbenzoate hydrochloride CAS Name: 4-methylbenzoic acid [2-acetyloxy-5-[2-(tert-butylamino)-1-oxoethyl]phenyl] ester hydrochloride IUPAC Name: [2-acetyloxy-5-[2-(tert-butylamino)acetyl]phenyl] 4-methylbenzoate hydrochloride Traditional Name: 4-methylbenzoic acid [2-acetoxy-5-[2-(tert-butylamino)acetyl]phenyl] ester hydrochloride Formula: C22H26ClNO5 MolecularWeight: 419.89854

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)OC2=C(C=CC(=C2)C(=O)CNC(C)(C)C)OC(=O)C.Cl

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)OC2=C(C=CC(=C2)C(=O)CNC(C)(C)C)OC(=O)C.Cl

InChI

InChI=1S/C22H25NO5.ClH/c1-14-6-8-16(9-7-14)21(26)28-20-12-17(10-11-19(20)27-15(2)24)18(25)13-23-22(3,4)5;/h6-12,23H,13H2,1-5H3;1H