(2S,3S)-3-methyl-2-[[(2-methylpropan-2-yl)oxycarbonylamino]-(phenylmethyl)amino]pentanoate

Systemtic Name: (2S,3S)-3-methyl-2-[[(2-methylpropan-2-yl)oxycarbonylamino]-(phenylmethyl)amino]pentanoate Openeye Name: (2S,3S)-2-[benzyl-(tert-butoxycarbonylamino)amino]-3-methyl-pentanoate CAS Name: (2S,3S)-3-methyl-2-[[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-(phenylmethyl)amino]pentanoate IUPAC Name: (2S,3S)-2-[benzyl-[(2-methylpropan-2-yl)oxycarbonylamino]amino]-3-methylpentanoate Traditional Name: (2S,3S)-2-[benzyl-(tert-butoxycarbonylamino)amino]-3-methyl-valerate Formula: C18H27N2O4- MolecularWeight: 335.41798

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H28N2O4/c1-6-13(2)15(16(21)22)20(12-14-10-8-7-9-11-14)19-17(23)24-18(3,4)5/h7-11,13,15H,6,12H2,1-5H3,(H,19,23)(H,21,22)/p-1/t13-,15-/m0/s1