[4-[2-[(tert-butylamino)methyl]butanoyl]-2-(4-methylphenyl)carbonyloxy-phenyl] 4-methylbenzoate

Systemtic Name: [4-[2-[(tert-butylamino)methyl]butanoyl]-2-(4-methylphenyl)carbonyloxy-phenyl] 4-methylbenzoate Openeye Name: [4-[2-[(tert-butylamino)methyl]butanoyl]-2-(4-methylbenzoyl)oxy-phenyl] 4-methylbenzoate CAS Name: 4-methylbenzoic acid [4-[2-[(tert-butylamino)methyl]-1-oxobutyl]-2-[(4-methylphenyl)-oxomethoxy]phenyl] ester IUPAC Name: [4-[2-[(tert-butylamino)methyl]butanoyl]-2-(4-methylbenzoyl)oxyphenyl] 4-methylbenzoate Traditional Name: 4-methylbenzoic acid [4-[2-[(tert-butylamino)methyl]butanoyl]-2-p-toluoyloxy-phenyl] ester Formula: C31H35NO5 MolecularWeight: 501.6133

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CNC(C)(C)C)C(=O)C1=CC(=C(C=C1)OC(=O)C2=CC=C(C=C2)C)OC(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCC(CNC(C)(C)C)C(=O)C1=CC(=C(C=C1)OC(=O)C2=CC=C(C=C2)C)OC(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C31H35NO5/c1-7-22(19-32-31(4,5)6)28(33)25-16-17-26(36-29(34)23-12-8-20(2)9-13-23)27(18-25)37-30(35)24-14-10-21(3)11-15-24/h8-18,22,32H,7,19H2,1-6H3