dimethyl (2S)-2-[[(2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenyl-propanoyl]amino]hexanedioate

Systemtic Name: dimethyl (2S)-2-[[(2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenyl-propanoyl]amino]hexanedioate Openeye Name: dimethyl (2S)-2-[[(2R)-2-(tert-butoxycarbonylamino)-3-phenyl-propanoyl]amino]hexanedioate CAS Name: (2S)-2-[[(2R)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxo-3-phenylpropyl]amino]hexanedioic acid dimethyl ester IUPAC Name: dimethyl (2S)-2-[[(2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylpropanoyl]amino]hexanedioate Traditional Name: (2S)-2-[[(2R)-2-(tert-butoxycarbonylamino)-3-phenyl-propanoyl]amino]adipic acid dimethyl ester Formula: C22H32N2O7 MolecularWeight: 436.49868

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CC=CC=C1)C(=O)NC(CCCC(=O)OC)C(=O)OC

Isomeric SMILES

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

InChI

InChI=1S/C22H32N2O7/c1-22(2,3)31-21(28)24-17(14-15-10-7-6-8-11-15)19(26)23-16(20(27)30-5)12-9-13-18(25)29-4/h6-8,10-11,16-17H,9,12-14H2,1-5H3,(H,23,26)(H,24,28)/t16-,17+/m0/s1