ethyl (E,4S)-2-[(4-methoxyphenyl)methyl]-4-[(2-methylpropan-2-yl)oxycarbonylamino]-5-phenyl-pent-2-enoate

Systemtic Name: ethyl (E,4S)-2-[(4-methoxyphenyl)methyl]-4-[(2-methylpropan-2-yl)oxycarbonylamino]-5-phenyl-pent-2-enoate Openeye Name: ethyl (E,4S)-4-(tert-butoxycarbonylamino)-2-[(4-methoxyphenyl)methyl]-5-phenyl-pent-2-enoate CAS Name: (E,4S)-2-[(4-methoxyphenyl)methyl]-4-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-5-phenyl-2-pentenoic acid ethyl ester IUPAC Name: ethyl (E,4S)-2-[(4-methoxyphenyl)methyl]-4-[(2-methylpropan-2-yl)oxycarbonylamino]-5-phenylpent-2-enoate Traditional Name: (E,4S)-4-(tert-butoxycarbonylamino)-2-p-anisyl-5-phenyl-pent-2-enoic acid ethyl ester Formula: C26H33NO5 MolecularWeight: 439.54392

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CC(CC1=CC=CC=C1)NC(=O)OC(C)(C)C)CC2=CC=C(C=C2)OC

Isomeric SMILES

CCOC(=O)/C(=C/[C@H](CC1=CC=CC=C1)NC(=O)OC(C)(C)C)/CC2=CC=C(C=C2)OC

InChI

InChI=1S/C26H33NO5/c1-6-31-24(28)21(16-20-12-14-23(30-5)15-13-20)18-22(17-19-10-8-7-9-11-19)27-25(29)32-26(2,3)4/h7-15,18,22H,6,16-17H2,1-5H3,(H,27,29)/b21-18+/t22-/m0/s1