[2-(cyclopropylamino)-2-oxidanylidene-ethyl] 3,5-ditert-butylbenzoate

Systemtic Name: [2-(cyclopropylamino)-2-oxidanylidene-ethyl] 3,5-ditert-butylbenzoate Openeye Name: [2-(cyclopropylamino)-2-oxo-ethyl] 3,5-ditert-butylbenzoate CAS Name: 3,5-ditert-butylbenzoic acid [2-(cyclopropylamino)-2-oxoethyl] ester IUPAC Name: [2-(cyclopropylamino)-2-oxoethyl] 3,5-ditert-butylbenzoate Traditional Name: 3,5-ditert-butylbenzoic acid [2-(cyclopropylamino)-2-keto-ethyl] ester Formula: C20H29NO3 MolecularWeight: 331.44916

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1)C(=O)OCC(=O)NC2CC2)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1)C(=O)OCC(=O)NC2CC2)C(C)(C)C

InChI

InChI=1S/C20H29NO3/c1-19(2,3)14-9-13(10-15(11-14)20(4,5)6)18(23)24-12-17(22)21-16-7-8-16/h9-11,16H,7-8,12H2,1-6H3,(H,21,22)