ethyl 6-[2-[[3-methoxy-4-[[2-[4-[(2-methylpropan-2-yl)oxycarbonylamino]butan-2-yloxy]phenyl]carbonylamino]phenyl]carbonyl-methyl-amino]-5-methyl-phenoxy]hexanoate

Systemtic Name: ethyl 6-[2-[[3-methoxy-4-[[2-[4-[(2-methylpropan-2-yl)oxycarbonylamino]butan-2-yloxy]phenyl]carbonylamino]phenyl]carbonyl-methyl-amino]-5-methyl-phenoxy]hexanoate Openeye Name: ethyl 6-[2-[[4-[[2-[3-(tert-butoxycarbonylamino)-1-methyl-propoxy]benzoyl]amino]-3-methoxy-benzoyl]-methyl-amino]-5-methyl-phenoxy]hexanoate CAS Name: 6-[2-[[[3-methoxy-4-[[[2-[4-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]butan-2-yloxy]phenyl]-oxomethyl]amino]phenyl]-oxomethyl]-methylamino]-5-methylphenoxy]hexanoic acid ethyl ester IUPAC Name: ethyl 6-[2-[[3-methoxy-4-[[2-[4-[(2-methylpropan-2-yl)oxycarbonylamino]butan-2-yloxy]benzoyl]amino]benzoyl]-methylamino]-5-methylphenoxy]hexanoate Traditional Name: 6-[2-[[4-[[2-[3-(tert-butoxycarbonylamino)-1-methyl-propoxy]benzoyl]amino]-3-methoxy-benzoyl]-methyl-amino]-5-methyl-phenoxy]hexanoic acid ethyl ester Formula: C40H53N3O9 MolecularWeight: 719.86352

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCCCOC1=C(C=CC(=C1)C)N(C)C(=O)C2=CC(=C(C=C2)NC(=O)C3=CC=CC=C3OC(C)CCNC(=O)OC(C)(C)C)OC

Isomeric SMILES

CCOC(=O)CCCCCOC1=C(C=CC(=C1)C)N(C)C(=O)C2=CC(=C(C=C2)NC(=O)C3=CC=CC=C3OC(C)CCNC(=O)OC(C)(C)C)OC

InChI

InChI=1S/C40H53N3O9/c1-9-49-36(44)17-11-10-14-24-50-35-25-27(2)18-21-32(35)43(7)38(46)29-19-20-31(34(26-29)48-8)42-37(45)30-15-12-13-16-33(30)51-28(3)22-23-41-39(47)52-40(4,5)6/h12-13,15-16,18-21,25-26,28H,9-11,14,17,22-24H2,1-8H3,(H,41,47)(H,42,45)