methyl (2R)-2-[[(2S)-3-(1H-indol-3-yl)-2-[[(2R,6S)-6-[(1S)-3-methyl-1-[(2-methylpropan-2-yl)oxycarbonylamino]butyl]oxan-2-yl]carbonylamino]propanoyl]amino]-4-methyl-pentanoate

Systemtic Name: methyl (2R)-2-[[(2S)-3-(1H-indol-3-yl)-2-[[(2R,6S)-6-[(1S)-3-methyl-1-[(2-methylpropan-2-yl)oxycarbonylamino]butyl]oxan-2-yl]carbonylamino]propanoyl]amino]-4-methyl-pentanoate Openeye Name: methyl (2R)-2-[[(2S)-2-[[(2R,6S)-6-[(1S)-1-(tert-butoxycarbonylamino)-3-methyl-butyl]tetrahydropyran-2-carbonyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]-4-methyl-pentanoate CAS Name: (2R)-2-[[(2S)-3-(1H-indol-3-yl)-2-[[[(2R,6S)-6-[(1S)-3-methyl-1-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]butyl]-2-oxanyl]-oxomethyl]amino]-1-oxopropyl]amino]-4-methylpentanoic acid methyl ester IUPAC Name: methyl (2R)-2-[[(2S)-3-(1H-indol-3-yl)-2-[[(2R,6S)-6-[(1S)-3-methyl-1-[(2-methylpropan-2-yl)oxycarbonylamino]butyl]oxane-2-carbonyl]amino]propanoyl]amino]-4-methylpentanoate Traditional Name: (2R)-2-[[(2S)-2-[[(2R,6S)-6-[(1S)-1-(tert-butoxycarbonylamino)-3-methyl-butyl]tetrahydropyran-2-carbonyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]-4-methyl-valeric acid methyl ester Formula: C34H52N4O7 MolecularWeight: 628.79928

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C1CCCC(O1)C(=O)NC(CC2=CNC3=CC=CC=C32)C(=O)NC(CC(C)C)C(=O)OC)NC(=O)OC(C)(C)C

Isomeric SMILES

CC(C)C[C@@H]([C@@H]1CCC[C@@H](O1)C(=O)N[C@@H](CC2=CNC3=CC=CC=C32)C(=O)N[C@H](CC(C)C)C(=O)OC)NC(=O)OC(C)(C)C

InChI

InChI=1S/C34H52N4O7/c1-20(2)16-25(38-33(42)45-34(5,6)7)28-14-11-15-29(44-28)31(40)36-26(18-22-19-35-24-13-10-9-12-23(22)24)30(39)37-27(17-21(3)4)32(41)43-8/h9-10,12-13,19-21,25-29,35H,11,14-18H2,1-8H3,(H,36,40)(H,37,39)(H,38,42)/t25-,26-,27+,28-,29+/m0/s1