tert-butyl (2E)-2-ethylidene-6-[(2-methylpropan-2-yl)oxycarbonyl-(phenylmethyl)amino]hexanoate

Systemtic Name: tert-butyl (2E)-2-ethylidene-6-[(2-methylpropan-2-yl)oxycarbonyl-(phenylmethyl)amino]hexanoate Openeye Name: tert-butyl (2E)-6-[benzyl(tert-butoxycarbonyl)amino]-2-ethylidene-hexanoate CAS Name: (2E)-2-ethylidene-6-[[(2-methylpropan-2-yl)oxy-oxomethyl]-(phenylmethyl)amino]hexanoic acid tert-butyl ester IUPAC Name: tert-butyl (2E)-6-[benzyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-2-ethylidenehexanoate Traditional Name: (E)-2-[4-[benzyl(tert-butoxycarbonyl)amino]butyl]but-2-enoic acid tert-butyl ester Formula: C24H37NO4 MolecularWeight: 403.55488

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Descriptors Computed from Structure

Canonical SMILES:

CC=C(CCCCN(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/c1-8-20(21(26)28-23(2,3)4)16-12-13-17-25(22(27)29-24(5,6)7)18-19-14-10-9-11-15-19/h8-11,14-15H,12-13,16-18H2,1-7H3/b20-8+