tert-butyl N-[(2S)-1-[[1-[[(2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenyl-propanoyl]amino]-3-oxidanyl-propyl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl]carbamate

Systemtic Name: tert-butyl N-[(2S)-1-[[1-[[(2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenyl-propanoyl]amino]-3-oxidanyl-propyl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl]carbamate Openeye Name: tert-butyl N-[(1S)-1-benzyl-2-[[1-[[(2R)-2-(tert-butoxycarbonylamino)-3-phenyl-propanoyl]amino]-3-hydroxy-propyl]amino]-2-oxo-ethyl]carbamate CAS Name: N-[(2S)-1-[[3-hydroxy-1-[[(2R)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxo-3-phenylpropyl]amino]propyl]amino]-1-oxo-3-phenylpropan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2S)-1-[[3-hydroxy-1-[[(2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylpropanoyl]amino]propyl]amino]-1-oxo-3-phenylpropan-2-yl]carbamate Traditional Name: N-[(1S)-1-benzyl-2-[[1-[[(2R)-2-(tert-butoxycarbonylamino)-3-phenyl-propanoyl]amino]-3-hydroxy-propyl]amino]-2-keto-ethyl]carbamic acid tert-butyl ester Formula: C31H44N4O7 MolecularWeight: 584.70366

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Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C31H44N4O7/c1-30(2,3)41-28(39)32-23(19-21-13-9-7-10-14-21)26(37)34-25(17-18-36)35-27(38)24(20-22-15-11-8-12-16-22)33-29(40)42-31(4,5)6/h7-16,23-25,36H,17-20H2,1-6H3,(H,32,39)(H,33,40)(H,34,37)(H,35,38)/t23-,24+,25?