methyl (2R)-2-[[2-[[(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-phenyl-propanoyl]amino]phenyl]carbonylamino]-3-(1H-indol-3-yl)propanoate

Systemtic Name: methyl (2R)-2-[[2-[[(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-phenyl-propanoyl]amino]phenyl]carbonylamino]-3-(1H-indol-3-yl)propanoate Openeye Name: methyl (2R)-2-[[2-[[(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-phenyl-propanoyl]amino]benzoyl]amino]-3-(1H-indol-3-yl)propanoate CAS Name: (2R)-2-[[[2-[[(2S)-2-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]-1-oxo-3-phenylpropyl]amino]phenyl]-oxomethyl]amino]-3-(1H-indol-3-yl)propanoic acid methyl ester IUPAC Name: methyl (2R)-2-[[2-[[(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-phenylpropanoyl]amino]benzoyl]amino]-3-(1H-indol-3-yl)propanoate Traditional Name: (2R)-2-[[2-[[(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-phenyl-propanoyl]amino]benzoyl]amino]-3-(1H-indol-3-yl)propionic acid methyl ester Formula: C43H38N4O6 MolecularWeight: 706.78502

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CNC2=CC=CC=C21)NC(=O)C3=CC=CC=C3NC(=O)C(CC4=CC=CC=C4)NC(=O)OCC5C6=CC=CC=C6C7=CC=CC=C57

Isomeric SMILES

COC(=O)[C@@H](CC1=CNC2=CC=CC=C21)NC(=O)C3=CC=CC=C3NC(=O)[C@H](CC4=CC=CC=C4)NC(=O)OCC5C6=CC=CC=C6C7=CC=CC=C57

InChI

InChI=1S/C43H38N4O6/c1-52-42(50)39(24-28-25-44-36-21-11-9-15-29(28)36)46-40(48)34-20-10-12-22-37(34)45-41(49)38(23-27-13-3-2-4-14-27)47-43(51)53-26-35-32-18-7-5-16-30(32)31-17-6-8-19-33(31)35/h2-22,25,35,38-39,44H,23-24,26H2,1H3,(H,45,49)(H,46,48)(H,47,51)/t38-,39+/m0/s1