tert-butyl [(2-methylpropan-2-yl)oxycarbonyl-[(E)-3-(3-phenoxyphenyl)hept-2-enyl]amino] carbonate

Systemtic Name: tert-butyl [(2-methylpropan-2-yl)oxycarbonyl-[(E)-3-(3-phenoxyphenyl)hept-2-enyl]amino] carbonate Openeye Name: [tert-butoxycarbonyl-[(E)-3-(3-phenoxyphenyl)hept-2-enyl]amino] tert-butyl carbonate CAS Name: carbonic acid tert-butyl [[(2-methylpropan-2-yl)oxy-oxomethyl]-[(E)-3-(3-phenoxyphenyl)hept-2-enyl]amino] ester IUPAC Name: tert-butyl [(2-methylpropan-2-yl)oxycarbonyl-[(E)-3-(3-phenoxyphenyl)hept-2-enyl]amino] carbonate Traditional Name: carbonic acid [tert-butoxycarbonyl-[(E)-3-(3-phenoxyphenyl)hept-2-enyl]amino] tert-butyl ester Formula: C29H39NO6 MolecularWeight: 497.62306

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=CCN(C(=O)OC(C)(C)C)OC(=O)OC(C)(C)C)C1=CC(=CC=C1)OC2=CC=CC=C2

Isomeric SMILES

CCCC/C(=C\CN(C(=O)OC(C)(C)C)OC(=O)OC(C)(C)C)/C1=CC(=CC=C1)OC2=CC=CC=C2

InChI

InChI=1S/C29H39NO6/c1-8-9-14-22(23-15-13-18-25(21-23)33-24-16-11-10-12-17-24)19-20-30(26(31)34-28(2,3)4)36-27(32)35-29(5,6)7/h10-13,15-19,21H,8-9,14,20H2,1-7H3/b22-19+