methyl (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[4-[5-[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxidanylidene-3-phenylmethoxy-propyl]-2-phenylmethoxy-phenoxy]phenyl]propanoate

Systemtic Name: methyl (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[4-[5-[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxidanylidene-3-phenylmethoxy-propyl]-2-phenylmethoxy-phenoxy]phenyl]propanoate Openeye Name: methyl (2S)-3-[4-[2-benzyloxy-5-[(2S)-3-benzyloxy-2-(tert-butoxycarbonylamino)-3-oxo-propyl]phenoxy]phenyl]-2-(tert-butoxycarbonylamino)propanoate CAS Name: (2S)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-[4-[5-[(2S)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-oxo-3-phenylmethoxypropyl]-2-phenylmethoxyphenoxy]phenyl]propanoic acid methyl ester IUPAC Name: methyl (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[4-[5-[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxo-3-phenylmethoxypropyl]-2-phenylmethoxyphenoxy]phenyl]propanoate Traditional Name: (2S)-3-[4-[2-benzoxy-5-[(2S)-3-benzoxy-2-(tert-butoxycarbonylamino)-3-keto-propyl]phenoxy]phenyl]-2-(tert-butoxycarbonylamino)propionic acid methyl ester Formula: C43H50N2O10 MolecularWeight: 754.8645

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CC=C(C=C1)OC2=C(C=CC(=C2)CC(C(=O)OCC3=CC=CC=C3)NC(=O)OC(C)(C)C)OCC4=CC=CC=C4)C(=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CC1=CC=C(C=C1)OC2=C(C=CC(=C2)C[C@@H](C(=O)OCC3=CC=CC=C3)NC(=O)OC(C)(C)C)OCC4=CC=CC=C4)C(=O)OC

InChI

InChI=1S/C43H50N2O10/c1-42(2,3)54-40(48)44-34(38(46)50-7)24-29-18-21-33(22-19-29)53-37-26-32(20-23-36(37)51-27-30-14-10-8-11-15-30)25-35(45-41(49)55-43(4,5)6)39(47)52-28-31-16-12-9-13-17-31/h8-23,26,34-35H,24-25,27-28H2,1-7H3,(H,44,48)(H,45,49)/t34-,35-/m0/s1