[[(2S)-2-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethanoylamino]-3-phenyl-propanoyl]amino] ethanoate

Systemtic Name: [[(2S)-2-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethanoylamino]-3-phenyl-propanoyl]amino] ethanoate Openeye Name: [[(2S)-2-[[2-(tert-butoxycarbonylamino)acetyl]amino]-3-phenyl-propanoyl]amino] acetate CAS Name: acetic acid [[(2S)-2-[[2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxoethyl]amino]-1-oxo-3-phenylpropyl]amino] ester IUPAC Name: [[(2S)-2-[[2-[(2-methylpropan-2-yl)oxycarbonylamino]acetyl]amino]-3-phenylpropanoyl]amino] acetate Traditional Name: acetic acid [[(2S)-2-[[2-(tert-butoxycarbonylamino)acetyl]amino]-3-phenyl-propanoyl]amino] ester Formula: C18H25N3O6 MolecularWeight: 379.4076

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)ONC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)OC(C)(C)C

Isomeric SMILES

CC(=O)ONC(=O)[C@H](CC1=CC=CC=C1)NC(=O)CNC(=O)OC(C)(C)C

InChI

InChI=1S/C18H25N3O6/c1-12(22)27-21-16(24)14(10-13-8-6-5-7-9-13)20-15(23)11-19-17(25)26-18(2,3)4/h5-9,14H,10-11H2,1-4H3,(H,19,25)(H,20,23)(H,21,24)/t14-/m0/s1