tert-butyl (E)-2-methyl-7-[(2-methylpropan-2-yl)oxycarbonyl-(phenylmethyl)amino]hept-2-enoate

Systemtic Name: tert-butyl (E)-2-methyl-7-[(2-methylpropan-2-yl)oxycarbonyl-(phenylmethyl)amino]hept-2-enoate Openeye Name: tert-butyl (E)-7-[benzyl(tert-butoxycarbonyl)amino]-2-methyl-hept-2-enoate CAS Name: (E)-2-methyl-7-[[(2-methylpropan-2-yl)oxy-oxomethyl]-(phenylmethyl)amino]-2-heptenoic acid tert-butyl ester IUPAC Name: tert-butyl (E)-7-[benzyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-2-methylhept-2-enoate Traditional Name: (E)-7-[benzyl(tert-butoxycarbonyl)amino]-2-methyl-hept-2-enoic acid tert-butyl ester Formula: C24H37NO4 MolecularWeight: 403.55488

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCCCCN(CC1=CC=CC=C1)C(=O)OC(C)(C)C)C(=O)OC(C)(C)C

Isomeric SMILES

C/C(=C\CCCCN(CC1=CC=CC=C1)C(=O)OC(C)(C)C)/C(=O)OC(C)(C)C

InChI

InChI=1S/C24H37NO4/c1-19(21(26)28-23(2,3)4)14-10-9-13-17-25(22(27)29-24(5,6)7)18-20-15-11-8-12-16-20/h8,11-12,14-16H,9-10,13,17-18H2,1-7H3/b19-14+