2,5-bis[[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenyl-propanoyl]amino]pentanoic acid

Systemtic Name: 2,5-bis[[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenyl-propanoyl]amino]pentanoic acid Openeye Name: 2,5-bis[[(2S)-2-(tert-butoxycarbonylamino)-3-phenyl-propanoyl]amino]pentanoic acid CAS Name: 2,5-bis[[(2S)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxo-3-phenylpropyl]amino]pentanoic acid IUPAC Name: 2,5-bis[[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylpropanoyl]amino]pentanoic acid Traditional Name: 2,5-bis[[(2S)-2-(tert-butoxycarbonylamino)-3-phenyl-propanoyl]amino]valeric acid Formula: C33H46N4O8 MolecularWeight: 626.74034

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CC=CC=C1)C(=O)NCCCC(C(=O)O)NC(=O)C(CC2=CC=CC=C2)NC(=O)OC(C)(C)C

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CC1=CC=CC=C1)C(=O)NCCCC(C(=O)O)NC(=O)[C@H](CC2=CC=CC=C2)NC(=O)OC(C)(C)C

InChI

InChI=1S/C33H46N4O8/c1-32(2,3)44-30(42)36-25(20-22-14-9-7-10-15-22)27(38)34-19-13-18-24(29(40)41)35-28(39)26(21-23-16-11-8-12-17-23)37-31(43)45-33(4,5)6/h7-12,14-17,24-26H,13,18-21H2,1-6H3,(H,34,38)(H,35,39)(H,36,42)(H,37,43)(H,40,41)/t24?,25-,26-/m0/s1