[2-(cyclopropylamino)-2-oxidanylidene-1-phenyl-ethyl] 2,4,6-trimethylbenzoate

Systemtic Name: [2-(cyclopropylamino)-2-oxidanylidene-1-phenyl-ethyl] 2,4,6-trimethylbenzoate Openeye Name: [2-(cyclopropylamino)-2-oxo-1-phenyl-ethyl] 2,4,6-trimethylbenzoate CAS Name: 2,4,6-trimethylbenzoic acid [2-(cyclopropylamino)-2-oxo-1-phenylethyl] ester IUPAC Name: [2-(cyclopropylamino)-2-oxo-1-phenylethyl] 2,4,6-trimethylbenzoate Traditional Name: 2,4,6-trimethylbenzoic acid [2-(cyclopropylamino)-2-keto-1-phenyl-ethyl] ester Formula: C21H23NO3 MolecularWeight: 337.41222

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)C(=O)OC(C2=CC=CC=C2)C(=O)NC3CC3)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)C(=O)OC(C2=CC=CC=C2)C(=O)NC3CC3)C

InChI

InChI=1S/C21H23NO3/c1-13-11-14(2)18(15(3)12-13)21(24)25-19(16-7-5-4-6-8-16)20(23)22-17-9-10-17/h4-8,11-12,17,19H,9-10H2,1-3H3,(H,22,23)