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

Systemtic Name: [(2R)-1-(cyclopropylamino)-1-oxidanylidene-propan-2-yl] 4-[(4-tert-butylphenoxy)methyl]benzoate Openeye Name: [(1R)-2-(cyclopropylamino)-1-methyl-2-oxo-ethyl] 4-[(4-tert-butylphenoxy)methyl]benzoate CAS Name: 4-[(4-tert-butylphenoxy)methyl]benzoic acid [(2R)-1-(cyclopropylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(cyclopropylamino)-1-oxopropan-2-yl] 4-[(4-tert-butylphenoxy)methyl]benzoate Traditional Name: 4-[(4-tert-butylphenoxy)methyl]benzoic acid [(1R)-2-(cyclopropylamino)-2-keto-1-methyl-ethyl] ester Formula: C24H29NO4 MolecularWeight: 395.49136

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CC1)OC(=O)C2=CC=C(C=C2)COC3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

C[C@H](C(=O)NC1CC1)OC(=O)C2=CC=C(C=C2)COC3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C24H29NO4/c1-16(22(26)25-20-11-12-20)29-23(27)18-7-5-17(6-8-18)15-28-21-13-9-19(10-14-21)24(2,3)4/h5-10,13-14,16,20H,11-12,15H2,1-4H3,(H,25,26)/t16-/m1/s1