[(2S)-1-[tert-butyl-(phenylmethyl)amino]-1-oxidanylidene-propan-2-yl] 4-(2-azanyl-2-oxidanylidene-ethoxy)benzoate

Systemtic Name: [(2S)-1-[tert-butyl-(phenylmethyl)amino]-1-oxidanylidene-propan-2-yl] 4-(2-azanyl-2-oxidanylidene-ethoxy)benzoate Openeye Name: [(1S)-2-[benzyl(tert-butyl)amino]-1-methyl-2-oxo-ethyl] 4-(2-amino-2-oxo-ethoxy)benzoate CAS Name: 4-(2-amino-2-oxoethoxy)benzoic acid [(2S)-1-[tert-butyl-(phenylmethyl)amino]-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-[benzyl(tert-butyl)amino]-1-oxopropan-2-yl] 4-(2-amino-2-oxoethoxy)benzoate Traditional Name: 4-(2-amino-2-keto-ethoxy)benzoic acid [(1S)-2-[benzyl(tert-butyl)amino]-2-keto-1-methyl-ethyl] ester Formula: C23H28N2O5 MolecularWeight: 412.47882

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N(CC1=CC=CC=C1)C(C)(C)C)OC(=O)C2=CC=C(C=C2)OCC(=O)N

Isomeric SMILES

C[C@@H](C(=O)N(CC1=CC=CC=C1)C(C)(C)C)OC(=O)C2=CC=C(C=C2)OCC(=O)N

InChI

InChI=1S/C23H28N2O5/c1-16(21(27)25(23(2,3)4)14-17-8-6-5-7-9-17)30-22(28)18-10-12-19(13-11-18)29-15-20(24)26/h5-13,16H,14-15H2,1-4H3,(H2,24,26)/t16-/m0/s1