pyridin-2-ylmethyl (2S)-2-[(4-tert-butylphenyl)carbonylamino]-3-methyl-butanoate

Systemtic Name: pyridin-2-ylmethyl (2S)-2-[(4-tert-butylphenyl)carbonylamino]-3-methyl-butanoate Openeye Name: 2-pyridylmethyl (2S)-2-[(4-tert-butylbenzoyl)amino]-3-methyl-butanoate CAS Name: (2S)-2-[[(4-tert-butylphenyl)-oxomethyl]amino]-3-methylbutanoic acid 2-pyridinylmethyl ester IUPAC Name: pyridin-2-ylmethyl (2S)-2-[(4-tert-butylbenzoyl)amino]-3-methylbutanoate Traditional Name: (2S)-2-[(4-tert-butylbenzoyl)amino]-3-methyl-butyric acid 2-pyridylmethyl ester Formula: C22H28N2O3 MolecularWeight: 368.46932

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCC1=CC=CC=N1)NC(=O)C2=CC=C(C=C2)C(C)(C)C

Isomeric SMILES

CC(C)[C@@H](C(=O)OCC1=CC=CC=N1)NC(=O)C2=CC=C(C=C2)C(C)(C)C

InChI

InChI=1S/C22H28N2O3/c1-15(2)19(21(26)27-14-18-8-6-7-13-23-18)24-20(25)16-9-11-17(12-10-16)22(3,4)5/h6-13,15,19H,14H2,1-5H3,(H,24,25)/t19-/m0/s1