[2,5-bis[[3-methyl-2-(pyridin-2-ylmethoxycarbonylamino)butanoyl]amino]-1,6-diphenyl-hexan-3-yl] methanoate

Systemtic Name: [2,5-bis[[3-methyl-2-(pyridin-2-ylmethoxycarbonylamino)butanoyl]amino]-1,6-diphenyl-hexan-3-yl] methanoate Openeye Name: [3-[[3-methyl-2-(2-pyridylmethoxycarbonylamino)butanoyl]amino]-1-[1-[[3-methyl-2-(2-pyridylmethoxycarbonylamino)butanoyl]amino]-2-phenyl-ethyl]-4-phenyl-butyl] formate CAS Name: formic acid [2,5-bis[[3-methyl-1-oxo-2-[[oxo(2-pyridinylmethoxy)methyl]amino]butyl]amino]-1,6-diphenylhexan-3-yl] ester IUPAC Name: [2,5-bis[[3-methyl-2-(pyridin-2-ylmethoxycarbonylamino)butanoyl]amino]-1,6-diphenylhexan-3-yl] formate Traditional Name: formic acid [3-[[3-methyl-2-(2-pyridylmethoxycarbonylamino)butanoyl]amino]-1-[1-[[3-methyl-2-(2-pyridylmethoxycarbonylamino)butanoyl]amino]-2-phenyl-ethyl]-4-phenyl-butyl] ester Formula: C43H52N6O8 MolecularWeight: 780.90838

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC(CC1=CC=CC=C1)CC(C(CC2=CC=CC=C2)NC(=O)C(C(C)C)NC(=O)OCC3=CC=CC=N3)OC=O)NC(=O)OCC4=CC=CC=N4

Isomeric SMILES

CC(C)C(C(=O)NC(CC1=CC=CC=C1)CC(C(CC2=CC=CC=C2)NC(=O)C(C(C)C)NC(=O)OCC3=CC=CC=N3)OC=O)NC(=O)OCC4=CC=CC=N4

InChI

InChI=1S/C43H52N6O8/c1-29(2)38(48-42(53)55-26-33-19-11-13-21-44-33)40(51)46-35(23-31-15-7-5-8-16-31)25-37(57-28-50)36(24-32-17-9-6-10-18-32)47-41(52)39(30(3)4)49-43(54)56-27-34-20-12-14-22-45-34/h5-22,28-30,35-39H,23-27H2,1-4H3,(H,46,51)(H,47,52)(H,48,53)(H,49,54)