ethyl (E,5S)-2-(2-methyl-1-oxidanyl-propyl)-5-[(2-methylpropan-2-yl)oxycarbonylamino]-6-phenyl-hex-3-enoate

Systemtic Name: ethyl (E,5S)-2-(2-methyl-1-oxidanyl-propyl)-5-[(2-methylpropan-2-yl)oxycarbonylamino]-6-phenyl-hex-3-enoate Openeye Name: ethyl (E,5S)-5-(tert-butoxycarbonylamino)-2-(1-hydroxy-2-methyl-propyl)-6-phenyl-hex-3-enoate CAS Name: (E,5S)-2-(1-hydroxy-2-methylpropyl)-5-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-6-phenyl-3-hexenoic acid ethyl ester IUPAC Name: ethyl (E,5S)-2-(1-hydroxy-2-methylpropyl)-5-[(2-methylpropan-2-yl)oxycarbonylamino]-6-phenylhex-3-enoate Traditional Name: (E,5S)-5-(tert-butoxycarbonylamino)-2-(1-hydroxy-2-methyl-propyl)-6-phenyl-hex-3-enoic acid ethyl ester Formula: C23H35NO5 MolecularWeight: 405.5277

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C=CC(CC1=CC=CC=C1)NC(=O)OC(C)(C)C)C(C(C)C)O

Isomeric SMILES

CCOC(=O)C(/C=C/[C@H](CC1=CC=CC=C1)NC(=O)OC(C)(C)C)C(C(C)C)O

InChI

InChI=1S/C23H35NO5/c1-7-28-21(26)19(20(25)16(2)3)14-13-18(15-17-11-9-8-10-12-17)24-22(27)29-23(4,5)6/h8-14,16,18-20,25H,7,15H2,1-6H3,(H,24,27)/b14-13+/t18-,19?,20?/m1/s1