2-cyclobutyl-2-[2-(1-cyclobutyl-2-oxidanyl-2-oxidanylidene-ethoxy)carbonyl-3,4-bis[(4-phenoxyphenyl)methyl-propyl-carbamoyl]cyclobutyl]carbonyloxy-ethanoic acid

Systemtic Name: 2-cyclobutyl-2-[2-(1-cyclobutyl-2-oxidanyl-2-oxidanylidene-ethoxy)carbonyl-3,4-bis[(4-phenoxyphenyl)methyl-propyl-carbamoyl]cyclobutyl]carbonyloxy-ethanoic acid Openeye Name: 2-cyclobutyl-2-[2-(1-cyclobutyl-2-hydroxy-2-oxo-ethoxy)carbonyl-3,4-bis[(4-phenoxyphenyl)methyl-propyl-carbamoyl]cyclobutanecarbonyl]oxy-acetic acid CAS Name: 2-cyclobutyl-2-[[2-[(1-cyclobutyl-2-hydroxy-2-oxoethoxy)-oxomethyl]-3,4-bis[oxo-[(4-phenoxyphenyl)methyl-propylamino]methyl]cyclobutyl]-oxomethoxy]acetic acid IUPAC Name: 2-cyclobutyl-2-[2-(1-cyclobutyl-2-hydroxy-2-oxoethoxy)carbonyl-3,4-bis[(4-phenoxyphenyl)methyl-propylcarbamoyl]cyclobutanecarbonyl]oxyacetic acid Traditional Name: 2-cyclobutyl-2-[2-(1-cyclobutyl-2-hydroxy-2-keto-ethoxy)carbonyl-3,4-bis[(4-phenoxybenzyl)-propyl-carbamoyl]cyclobutanecarbonyl]oxy-acetic acid Formula: C52H58N2O12 MolecularWeight: 903.02312

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC1=CC=C(C=C1)OC2=CC=CC=C2)C(=O)C3C(C(C3C(=O)OC(C4CCC4)C(=O)O)C(=O)OC(C5CCC5)C(=O)O)C(=O)N(CCC)CC6=CC=C(C=C6)OC7=CC=CC=C7

Isomeric SMILES

CCCN(CC1=CC=C(C=C1)OC2=CC=CC=C2)C(=O)C3C(C(C3C(=O)OC(C4CCC4)C(=O)O)C(=O)OC(C5CCC5)C(=O)O)C(=O)N(CCC)CC6=CC=C(C=C6)OC7=CC=CC=C7

InChI

InChI=1S/C52H58N2O12/c1-3-29-53(31-33-21-25-39(26-22-33)63-37-17-7-5-8-18-37)47(55)41-42(48(56)54(30-4-2)32-34-23-27-40(28-24-34)64-38-19-9-6-10-20-38)44(52(62)66-46(50(59)60)36-15-12-16-36)43(41)51(61)65-45(49(57)58)35-13-11-14-35/h5-10,17-28,35-36,41-46H,3-4,11-16,29-32H2,1-2H3,(H,57,58)(H,59,60)