ethyl 3-[[2-[[3-(4-hydroxyphenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoyl]-pentyl-amino]-2-(2-methylphenyl)ethanoyl]amino]propanoate

Systemtic Name: ethyl 3-[[2-[[3-(4-hydroxyphenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoyl]-pentyl-amino]-2-(2-methylphenyl)ethanoyl]amino]propanoate Openeye Name: ethyl 3-[[2-[[2-(tert-butoxycarbonylamino)-3-(4-hydroxyphenyl)propanoyl]-pentyl-amino]-2-(o-tolyl)acetyl]amino]propanoate CAS Name: 3-[[2-[[3-(4-hydroxyphenyl)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxopropyl]-pentylamino]-2-(2-methylphenyl)-1-oxoethyl]amino]propanoic acid ethyl ester IUPAC Name: ethyl 3-[[2-[[3-(4-hydroxyphenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoyl]-pentylamino]-2-(2-methylphenyl)acetyl]amino]propanoate Traditional Name: 3-[[2-[amyl-[2-(tert-butoxycarbonylamino)-3-(4-hydroxyphenyl)propanoyl]amino]-2-(o-tolyl)acetyl]amino]propionic acid ethyl ester Formula: C33H47N3O7 MolecularWeight: 597.74218

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(C(C1=CC=CC=C1C)C(=O)NCCC(=O)OCC)C(=O)C(CC2=CC=C(C=C2)O)NC(=O)OC(C)(C)C

Isomeric SMILES

CCCCCN(C(C1=CC=CC=C1C)C(=O)NCCC(=O)OCC)C(=O)C(CC2=CC=C(C=C2)O)NC(=O)OC(C)(C)C

InChI

InChI=1S/C33H47N3O7/c1-7-9-12-21-36(29(26-14-11-10-13-23(26)3)30(39)34-20-19-28(38)42-8-2)31(40)27(35-32(41)43-33(4,5)6)22-24-15-17-25(37)18-16-24/h10-11,13-18,27,29,37H,7-9,12,19-22H2,1-6H3,(H,34,39)(H,35,41)