methyl (2S)-3-[methyl-[2-[3-[4-[(Z)-N'-[(2-methylpropan-2-yl)oxycarbonyl]carbamimidoyl]phenyl]-4,5-dihydro-1,2-oxazol-5-yl]ethanoyl]amino]-2-(phenylmethoxycarbonylamino)propanoate

Systemtic Name: methyl (2S)-3-[methyl-[2-[3-[4-[(Z)-N'-[(2-methylpropan-2-yl)oxycarbonyl]carbamimidoyl]phenyl]-4,5-dihydro-1,2-oxazol-5-yl]ethanoyl]amino]-2-(phenylmethoxycarbonylamino)propanoate Openeye Name: methyl (2S)-2-(benzyloxycarbonylamino)-3-[[2-[3-[4-[(Z)-N'-tert-butoxycarbonylcarbamimidoyl]phenyl]-4,5-dihydroisoxazol-5-yl]acetyl]-methyl-amino]propanoate CAS Name: (2S)-3-[[2-[3-[4-[(Z)-amino-[(2-methylpropan-2-yl)oxy-oxomethyl]iminomethyl]phenyl]-4,5-dihydroisoxazol-5-yl]-1-oxoethyl]-methylamino]-2-(phenylmethoxycarbonylamino)propanoic acid methyl ester IUPAC Name: methyl (2S)-3-[methyl-[2-[3-[4-[(Z)-N'-[(2-methylpropan-2-yl)oxycarbonyl]carbamimidoyl]phenyl]-4,5-dihydro-1,2-oxazol-5-yl]acetyl]amino]-2-(phenylmethoxycarbonylamino)propanoate Traditional Name: (2S)-2-(benzyloxycarbonylamino)-3-[[2-[3-[4-[(Z)-N'-tert-butoxycarbonylamidino]phenyl]-2-isoxazolin-5-yl]acetyl]-methyl-amino]propionic acid methyl ester Formula: C30H37N5O8 MolecularWeight: 595.64348

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N=C(C1=CC=C(C=C1)C2=NOC(C2)CC(=O)N(C)CC(C(=O)OC)NC(=O)OCC3=CC=CC=C3)N

Isomeric SMILES

CC(C)(C)OC(=O)/N=C(/C1=CC=C(C=C1)C2=NOC(C2)CC(=O)N(C)C[C@@H](C(=O)OC)NC(=O)OCC3=CC=CC=C3)\N

InChI

InChI=1S/C30H37N5O8/c1-30(2,3)42-29(39)33-26(31)21-13-11-20(12-14-21)23-15-22(43-34-23)16-25(36)35(4)17-24(27(37)40-5)32-28(38)41-18-19-9-7-6-8-10-19/h6-14,22,24H,15-18H2,1-5H3,(H,32,38)(H2,31,33,39)/t22?,24-/m0/s1