methyl (2S)-3-methyl-2-[[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylmethoxy-propanoyl]amino]butanoate

Systemtic Name: methyl (2S)-3-methyl-2-[[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylmethoxy-propanoyl]amino]butanoate Openeye Name: methyl (2S)-2-[[(2S)-3-benzyloxy-2-(tert-butoxycarbonylamino)propanoyl]amino]-3-methyl-butanoate CAS Name: (2S)-3-methyl-2-[[(2S)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxo-3-phenylmethoxypropyl]amino]butanoic acid methyl ester IUPAC Name: methyl (2S)-3-methyl-2-[[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylmethoxypropanoyl]amino]butanoate Traditional Name: (2S)-2-[[(2S)-3-benzoxy-2-(tert-butoxycarbonylamino)propanoyl]amino]-3-methyl-butyric acid methyl ester Formula: C21H32N2O6 MolecularWeight: 408.48858

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OC)NC(=O)C(COCC1=CC=CC=C1)NC(=O)OC(C)(C)C

Isomeric SMILES

CC(C)[C@@H](C(=O)OC)NC(=O)[C@H](COCC1=CC=CC=C1)NC(=O)OC(C)(C)C

InChI

InChI=1S/C21H32N2O6/c1-14(2)17(19(25)27-6)23-18(24)16(22-20(26)29-21(3,4)5)13-28-12-15-10-8-7-9-11-15/h7-11,14,16-17H,12-13H2,1-6H3,(H,22,26)(H,23,24)/t16-,17-/m0/s1