[(2R)-1-(cyclopropylamino)-1-oxidanylidene-propan-2-yl] 4-(4-tert-butylphenoxy)butanoate

Systemtic Name: [(2R)-1-(cyclopropylamino)-1-oxidanylidene-propan-2-yl] 4-(4-tert-butylphenoxy)butanoate Openeye Name: [(1R)-2-(cyclopropylamino)-1-methyl-2-oxo-ethyl] 4-(4-tert-butylphenoxy)butanoate CAS Name: 4-(4-tert-butylphenoxy)butanoic acid [(2R)-1-(cyclopropylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(cyclopropylamino)-1-oxopropan-2-yl] 4-(4-tert-butylphenoxy)butanoate Traditional Name: 4-(4-tert-butylphenoxy)butyric acid [(1R)-2-(cyclopropylamino)-2-keto-1-methyl-ethyl] ester Formula: C20H29NO4 MolecularWeight: 347.44856

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CC1)OC(=O)CCCOC2=CC=C(C=C2)C(C)(C)C

Isomeric SMILES

C[C@H](C(=O)NC1CC1)OC(=O)CCCOC2=CC=C(C=C2)C(C)(C)C

InChI

InChI=1S/C20H29NO4/c1-14(19(23)21-16-9-10-16)25-18(22)6-5-13-24-17-11-7-15(8-12-17)20(2,3)4/h7-8,11-12,14,16H,5-6,9-10,13H2,1-4H3,(H,21,23)/t14-/m1/s1