[2-oxidanylidene-2-(3-phenylpropylamino)ethyl] 2,4,6-trimethylbenzoate

Systemtic Name: [2-oxidanylidene-2-(3-phenylpropylamino)ethyl] 2,4,6-trimethylbenzoate Openeye Name: [2-oxo-2-(3-phenylpropylamino)ethyl] 2,4,6-trimethylbenzoate CAS Name: 2,4,6-trimethylbenzoic acid [2-oxo-2-(3-phenylpropylamino)ethyl] ester IUPAC Name: [2-oxo-2-(3-phenylpropylamino)ethyl] 2,4,6-trimethylbenzoate Traditional Name: 2,4,6-trimethylbenzoic acid [2-keto-2-(3-phenylpropylamino)ethyl] ester Formula: C21H25NO3 MolecularWeight: 339.4281

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)C(=O)OCC(=O)NCCCC2=CC=CC=C2)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)C(=O)OCC(=O)NCCCC2=CC=CC=C2)C

InChI

InChI=1S/C21H25NO3/c1-15-12-16(2)20(17(3)13-15)21(24)25-14-19(23)22-11-7-10-18-8-5-4-6-9-18/h4-6,8-9,12-13H,7,10-11,14H2,1-3H3,(H,22,23)