(3-azanyl-3-oxidanylidene-propyl) (2S)-2-[(4-tert-butylphenyl)carbonylamino]-3-methyl-butanoate

Systemtic Name: (3-azanyl-3-oxidanylidene-propyl) (2S)-2-[(4-tert-butylphenyl)carbonylamino]-3-methyl-butanoate Openeye Name: (3-amino-3-oxo-propyl) (2S)-2-[(4-tert-butylbenzoyl)amino]-3-methyl-butanoate CAS Name: (2S)-2-[[(4-tert-butylphenyl)-oxomethyl]amino]-3-methylbutanoic acid (3-amino-3-oxopropyl) ester IUPAC Name: (3-amino-3-oxopropyl) (2S)-2-[(4-tert-butylbenzoyl)amino]-3-methylbutanoate Traditional Name: (2S)-2-[(4-tert-butylbenzoyl)amino]-3-methyl-butyric acid (3-amino-3-keto-propyl) ester Formula: C19H28N2O4 MolecularWeight: 348.43662

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCCC(=O)N)NC(=O)C1=CC=C(C=C1)C(C)(C)C

Isomeric SMILES

CC(C)[C@@H](C(=O)OCCC(=O)N)NC(=O)C1=CC=C(C=C1)C(C)(C)C

InChI

InChI=1S/C19H28N2O4/c1-12(2)16(18(24)25-11-10-15(20)22)21-17(23)13-6-8-14(9-7-13)19(3,4)5/h6-9,12,16H,10-11H2,1-5H3,(H2,20,22)(H,21,23)/t16-/m0/s1