[2-(cyclopropylamino)-2-oxidanylidene-ethyl] 2-(2,4-ditert-butylphenoxy)ethanoate

Systemtic Name: [2-(cyclopropylamino)-2-oxidanylidene-ethyl] 2-(2,4-ditert-butylphenoxy)ethanoate Openeye Name: [2-(cyclopropylamino)-2-oxo-ethyl] 2-(2,4-ditert-butylphenoxy)acetate CAS Name: 2-(2,4-ditert-butylphenoxy)acetic acid [2-(cyclopropylamino)-2-oxoethyl] ester IUPAC Name: [2-(cyclopropylamino)-2-oxoethyl] 2-(2,4-ditert-butylphenoxy)acetate Traditional Name: 2-(2,4-ditert-butylphenoxy)acetic acid [2-(cyclopropylamino)-2-keto-ethyl] ester Formula: C21H31NO4 MolecularWeight: 361.47514

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H31NO4/c1-20(2,3)14-7-10-17(16(11-14)21(4,5)6)25-13-19(24)26-12-18(23)22-15-8-9-15/h7,10-11,15H,8-9,12-13H2,1-6H3,(H,22,23)