ethyl 2-[[2-[[2,4-bis(fluoranyl)phenyl]methyl-[3-(phenylmethoxycarbonylamino)propanoyl]amino]-2-methyl-propanoyl]amino]ethanoate

Systemtic Name: ethyl 2-[[2-[[2,4-bis(fluoranyl)phenyl]methyl-[3-(phenylmethoxycarbonylamino)propanoyl]amino]-2-methyl-propanoyl]amino]ethanoate Openeye Name: ethyl 2-[[2-[3-(benzyloxycarbonylamino)propanoyl-[(2,4-difluorophenyl)methyl]amino]-2-methyl-propanoyl]amino]acetate CAS Name: 2-[[2-[(2,4-difluorophenyl)methyl-[1-oxo-3-(phenylmethoxycarbonylamino)propyl]amino]-2-methyl-1-oxopropyl]amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[[2-[(2,4-difluorophenyl)methyl-[3-(phenylmethoxycarbonylamino)propanoyl]amino]-2-methylpropanoyl]amino]acetate Traditional Name: 2-[[2-[3-(benzyloxycarbonylamino)propanoyl-(2,4-difluorobenzyl)amino]-2-methyl-propanoyl]amino]acetic acid ethyl ester Formula: C26H31F2N3O6 MolecularWeight: 519.537646

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CNC(=O)C(C)(C)N(CC1=C(C=C(C=C1)F)F)C(=O)CCNC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)CNC(=O)C(C)(C)N(CC1=C(C=C(C=C1)F)F)C(=O)CCNC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C26H31F2N3O6/c1-4-36-23(33)15-30-24(34)26(2,3)31(16-19-10-11-20(27)14-21(19)28)22(32)12-13-29-25(35)37-17-18-8-6-5-7-9-18/h5-11,14H,4,12-13,15-17H2,1-3H3,(H,29,35)(H,30,34)