tert-butyl (2S)-2-[[(2S,3S)-2-azanyl-3-methyl-pentanoyl]amino]-3-phenyl-propanoate

Systemtic Name: tert-butyl (2S)-2-[[(2S,3S)-2-azanyl-3-methyl-pentanoyl]amino]-3-phenyl-propanoate Openeye Name: tert-butyl (2S)-2-[[(2S,3S)-2-amino-3-methyl-pentanoyl]amino]-3-phenyl-propanoate CAS Name: (2S)-2-[[(2S,3S)-2-amino-3-methyl-1-oxopentyl]amino]-3-phenylpropanoic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-2-[[(2S,3S)-2-amino-3-methylpentanoyl]amino]-3-phenylpropanoate Traditional Name: (2S)-2-[[(2S,3S)-2-amino-3-methyl-pentanoyl]amino]-3-phenyl-propionic acid tert-butyl ester Formula: C19H30N2O3 MolecularWeight: 334.4531

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NC(CC1=CC=CC=C1)C(=O)OC(C)(C)C)N

Isomeric SMILES

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

InChI

InChI=1S/C19H30N2O3/c1-6-13(2)16(20)17(22)21-15(18(23)24-19(3,4)5)12-14-10-8-7-9-11-14/h7-11,13,15-16H,6,12,20H2,1-5H3,(H,21,22)/t13-,15-,16-/m0/s1