ethyl 5-methyl-5-[2-[3-[4-[(E)-N'-[(2-methylpropan-2-yl)oxycarbonyl]carbamimidoyl]phenyl]-4,5-dihydro-1,2-oxazol-5-yl]ethanoylamino]hexanoate

Systemtic Name: ethyl 5-methyl-5-[2-[3-[4-[(E)-N'-[(2-methylpropan-2-yl)oxycarbonyl]carbamimidoyl]phenyl]-4,5-dihydro-1,2-oxazol-5-yl]ethanoylamino]hexanoate Openeye Name: ethyl 5-[[2-[3-[4-[(E)-N'-tert-butoxycarbonylcarbamimidoyl]phenyl]-4,5-dihydroisoxazol-5-yl]acetyl]amino]-5-methyl-hexanoate CAS Name: 5-[[2-[3-[4-[(E)-amino-[(2-methylpropan-2-yl)oxy-oxomethyl]iminomethyl]phenyl]-4,5-dihydroisoxazol-5-yl]-1-oxoethyl]amino]-5-methylhexanoic acid ethyl ester IUPAC Name: ethyl 5-methyl-5-[[2-[3-[4-[(E)-N'-[(2-methylpropan-2-yl)oxycarbonyl]carbamimidoyl]phenyl]-4,5-dihydro-1,2-oxazol-5-yl]acetyl]amino]hexanoate Traditional Name: 5-[[2-[3-[4-[(E)-N'-tert-butoxycarbonylamidino]phenyl]-2-isoxazolin-5-yl]acetyl]amino]-5-methyl-hexanoic acid ethyl ester Formula: C26H38N4O6 MolecularWeight: 502.60312

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCC(C)(C)NC(=O)CC1CC(=NO1)C2=CC=C(C=C2)C(=NC(=O)OC(C)(C)C)N

Isomeric SMILES

CCOC(=O)CCCC(C)(C)NC(=O)CC1CC(=NO1)C2=CC=C(C=C2)/C(=N\C(=O)OC(C)(C)C)/N

InChI

InChI=1S/C26H38N4O6/c1-7-34-22(32)9-8-14-26(5,6)29-21(31)16-19-15-20(30-36-19)17-10-12-18(13-11-17)23(27)28-24(33)35-25(2,3)4/h10-13,19H,7-9,14-16H2,1-6H3,(H,29,31)(H2,27,28,33)