[2-(3-methylbutanoyloxy)-5-[2-(propan-2-ylamino)ethanoyl]phenyl] 4-methylbenzoate

Systemtic Name: [2-(3-methylbutanoyloxy)-5-[2-(propan-2-ylamino)ethanoyl]phenyl] 4-methylbenzoate Openeye Name: [5-[2-(isopropylamino)acetyl]-2-(3-methylbutanoyloxy)phenyl] 4-methylbenzoate CAS Name: 4-methylbenzoic acid [2-(3-methyl-1-oxobutoxy)-5-[1-oxo-2-(propan-2-ylamino)ethyl]phenyl] ester IUPAC Name: [2-(3-methylbutanoyloxy)-5-[2-(propan-2-ylamino)acetyl]phenyl] 4-methylbenzoate Traditional Name: 4-methylbenzoic acid [5-[2-(isopropylamino)acetyl]-2-isovaleryloxy-phenyl] ester Formula: C24H29NO5 MolecularWeight: 411.49076

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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)OC(=O)CC(C)C

Isomeric SMILES

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

InChI

InChI=1S/C24H29NO5/c1-15(2)12-23(27)29-21-11-10-19(20(26)14-25-16(3)4)13-22(21)30-24(28)18-8-6-17(5)7-9-18/h6-11,13,15-16,25H,12,14H2,1-5H3