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

Systemtic Name: ethyl (2S)-2-[[2-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoyl]amino]-3-phenylmethoxy-propanoate Openeye Name: ethyl (2S)-3-benzyloxy-2-[[2-(tert-butoxycarbonylamino)-2-methyl-propanoyl]amino]propanoate CAS Name: (2S)-2-[[2-methyl-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxopropyl]amino]-3-phenylmethoxypropanoic acid ethyl ester IUPAC Name: ethyl (2S)-2-[[2-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoyl]amino]-3-phenylmethoxypropanoate Traditional Name: (2S)-3-benzoxy-2-[[2-(tert-butoxycarbonylamino)-2-methyl-propanoyl]amino]propionic acid ethyl ester Formula: C21H32N2O6 MolecularWeight: 408.48858

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H32N2O6/c1-7-28-17(24)16(14-27-13-15-11-9-8-10-12-15)22-18(25)21(5,6)23-19(26)29-20(2,3)4/h8-12,16H,7,13-14H2,1-6H3,(H,22,25)(H,23,26)/t16-/m0/s1