(phenylmethyl) 2-[2-[2-[[(2S)-1-[2-[2-[2-[2-[2-[decyl(ethyl)amino]-2-oxidanylidene-ethoxy]ethanoylamino]ethanoylamino]ethanoylamino]ethanoyl]pyrrolidin-2-yl]carbonylamino]ethanoylamino]ethanoylamino]ethanoate

Systemtic Name: (phenylmethyl) 2-[2-[2-[[(2S)-1-[2-[2-[2-[2-[2-[decyl(ethyl)amino]-2-oxidanylidene-ethoxy]ethanoylamino]ethanoylamino]ethanoylamino]ethanoyl]pyrrolidin-2-yl]carbonylamino]ethanoylamino]ethanoylamino]ethanoate Openeye Name: benzyl 2-[[2-[[2-[[(2S)-1-[2-[[2-[[2-[[2-[2-[decyl(ethyl)amino]-2-oxo-ethoxy]acetyl]amino]acetyl]amino]acetyl]amino]acetyl]pyrrolidine-2-carbonyl]amino]acetyl]amino]acetyl]amino]acetate CAS Name: 2-[[2-[[2-[[[(2S)-1-[2-[[2-[[2-[[2-[2-[decyl(ethyl)amino]-2-oxoethoxy]-1-oxoethyl]amino]-1-oxoethyl]amino]-1-oxoethyl]amino]-1-oxoethyl]-2-pyrrolidinyl]-oxomethyl]amino]-1-oxoethyl]amino]-1-oxoethyl]amino]acetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[[2-[[2-[[(2S)-1-[2-[[2-[[2-[[2-[2-[decyl(ethyl)amino]-2-oxoethoxy]acetyl]amino]acetyl]amino]acetyl]amino]acetyl]pyrrolidine-2-carbonyl]amino]acetyl]amino]acetyl]amino]acetate Traditional Name: 2-[[2-[[2-[[(2S)-1-[2-[[2-[[2-[[2-[2-[decyl(ethyl)amino]-2-keto-ethoxy]acetyl]amino]acetyl]amino]acetyl]amino]acetyl]prolyl]amino]acetyl]amino]acetyl]amino]acetic acid benzyl ester Formula: C40H62N8O11 MolecularWeight: 830.96728

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCN(CC)C(=O)COCC(=O)NCC(=O)NCC(=O)NCC(=O)N1CCCC1C(=O)NCC(=O)NCC(=O)NCC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CCCCCCCCCCN(CC)C(=O)COCC(=O)NCC(=O)NCC(=O)NCC(=O)N1CCC[C@H]1C(=O)NCC(=O)NCC(=O)NCC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C40H62N8O11/c1-3-5-6-7-8-9-10-14-19-47(4-2)38(55)29-58-28-36(53)43-23-32(49)41-21-33(50)44-25-37(54)48-20-15-18-31(48)40(57)46-24-35(52)42-22-34(51)45-26-39(56)59-27-30-16-12-11-13-17-30/h11-13,16-17,31H,3-10,14-15,18-29H2,1-2H3,(H,41,49)(H,42,52)(H,43,53)(H,44,50)(H,45,51)(H,46,57)/t31-/m0/s1