ethyl 2-[(3R)-4-[(2R)-2-[[(2S)-3-(4-hydroxyphenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoyl]amino]propanoyl]-2-oxidanylidene-3-(phenylmethyl)piperazin-1-yl]ethanoate

Systemtic Name: ethyl 2-[(3R)-4-[(2R)-2-[[(2S)-3-(4-hydroxyphenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoyl]amino]propanoyl]-2-oxidanylidene-3-(phenylmethyl)piperazin-1-yl]ethanoate Openeye Name: ethyl 2-[(3R)-3-benzyl-4-[(2R)-2-[[(2S)-2-(tert-butoxycarbonylamino)-3-(4-hydroxyphenyl)propanoyl]amino]propanoyl]-2-oxo-piperazin-1-yl]acetate CAS Name: 2-[(3R)-4-[(2R)-2-[[(2S)-3-(4-hydroxyphenyl)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxopropyl]amino]-1-oxopropyl]-2-oxo-3-(phenylmethyl)-1-piperazinyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[(3R)-3-benzyl-4-[(2R)-2-[[(2S)-3-(4-hydroxyphenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoyl]amino]propanoyl]-2-oxopiperazin-1-yl]acetate Traditional Name: 2-[(3R)-3-benzyl-4-[(2R)-2-[[(2S)-2-(tert-butoxycarbonylamino)-3-(4-hydroxyphenyl)propanoyl]amino]propanoyl]-2-keto-piperazino]acetic acid ethyl ester Formula: C32H42N4O8 MolecularWeight: 610.69788

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1CCN(C(C1=O)CC2=CC=CC=C2)C(=O)C(C)NC(=O)C(CC3=CC=C(C=C3)O)NC(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)CN1CCN([C@@H](C1=O)CC2=CC=CC=C2)C(=O)[C@@H](C)NC(=O)[C@H](CC3=CC=C(C=C3)O)NC(=O)OC(C)(C)C

InChI

InChI=1S/C32H42N4O8/c1-6-43-27(38)20-35-16-17-36(26(30(35)41)19-22-10-8-7-9-11-22)29(40)21(2)33-28(39)25(34-31(42)44-32(3,4)5)18-23-12-14-24(37)15-13-23/h7-15,21,25-26,37H,6,16-20H2,1-5H3,(H,33,39)(H,34,42)/t21-,25+,26-/m1/s1