[4-[2-(tert-butylamino)ethanoyl]-2-oxidanyl-phenyl] 4-methoxybenzoate hydrochloride

Systemtic Name: [4-[2-(tert-butylamino)ethanoyl]-2-oxidanyl-phenyl] 4-methoxybenzoate hydrochloride Openeye Name: [4-[2-(tert-butylamino)acetyl]-2-hydroxy-phenyl] 4-methoxybenzoate hydrochloride CAS Name: 4-methoxybenzoic acid [4-[2-(tert-butylamino)-1-oxoethyl]-2-hydroxyphenyl] ester hydrochloride IUPAC Name: [4-[2-(tert-butylamino)acetyl]-2-hydroxyphenyl] 4-methoxybenzoate hydrochloride Traditional Name: 4-methoxybenzoic acid [4-[2-(tert-butylamino)acetyl]-2-hydroxy-phenyl] ester hydrochloride Formula: C20H24ClNO5 MolecularWeight: 393.86126

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NCC(=O)C1=CC(=C(C=C1)OC(=O)C2=CC=C(C=C2)OC)O.Cl

Isomeric SMILES

CC(C)(C)NCC(=O)C1=CC(=C(C=C1)OC(=O)C2=CC=C(C=C2)OC)O.Cl

InChI

InChI=1S/C20H23NO5.ClH/c1-20(2,3)21-12-17(23)14-7-10-18(16(22)11-14)26-19(24)13-5-8-15(25-4)9-6-13;/h5-11,21-22H,12H2,1-4H3;1H