methyl (E)-5-[(2-methylpropan-2-yl)oxycarbonylamino]-6-phenyl-2-(phenylmethyl)hex-3-enoate

Systemtic Name: methyl (E)-5-[(2-methylpropan-2-yl)oxycarbonylamino]-6-phenyl-2-(phenylmethyl)hex-3-enoate Openeye Name: methyl (E)-2-benzyl-5-(tert-butoxycarbonylamino)-6-phenyl-hex-3-enoate CAS Name: (E)-5-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-6-phenyl-2-(phenylmethyl)-3-hexenoic acid methyl ester IUPAC Name: methyl (E)-2-benzyl-5-[(2-methylpropan-2-yl)oxycarbonylamino]-6-phenylhex-3-enoate Traditional Name: (E)-2-benzyl-5-(tert-butoxycarbonylamino)-6-phenyl-hex-3-enoic acid methyl ester Formula: C25H31NO4 MolecularWeight: 409.51794

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H31NO4/c1-25(2,3)30-24(28)26-22(18-20-13-9-6-10-14-20)16-15-21(23(27)29-4)17-19-11-7-5-8-12-19/h5-16,21-22H,17-18H2,1-4H3,(H,26,28)/b16-15+