O1-ethyl O3-[(2-methylpropan-2-yl)oxycarbonylamino] 2-[(E)-7-(4-phenylmethoxyphenyl)hept-4-enyl]propanedioate

Systemtic Name: O1-ethyl O3-[(2-methylpropan-2-yl)oxycarbonylamino] 2-[(E)-7-(4-phenylmethoxyphenyl)hept-4-enyl]propanedioate Openeye Name: O1-(tert-butoxycarbonylamino) O3-ethyl 2-[(E)-7-(4-benzyloxyphenyl)hept-4-enyl]propanedioate CAS Name: 2-[(E)-7-(4-phenylmethoxyphenyl)hept-4-enyl]propanedioic acid O1-ethyl ester O3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino] ester IUPAC Name: 1-O-ethyl 3-O-[(2-methylpropan-2-yl)oxycarbonylamino] 2-[(E)-7-(4-phenylmethoxyphenyl)hept-4-enyl]propanedioate Traditional Name: 2-[(E)-7-(4-benzoxyphenyl)hept-4-enyl]malonic acid O1-(tert-butoxycarbonylamino) ester O3-ethyl ester Formula: C30H39NO7 MolecularWeight: 525.63316

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCCC=CCCC1=CC=C(C=C1)OCC2=CC=CC=C2)C(=O)ONC(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)C(CCC/C=C/CCC1=CC=C(C=C1)OCC2=CC=CC=C2)C(=O)ONC(=O)OC(C)(C)C

InChI

InChI=1S/C30H39NO7/c1-5-35-27(32)26(28(33)38-31-29(34)37-30(2,3)4)17-13-8-6-7-10-14-23-18-20-25(21-19-23)36-22-24-15-11-9-12-16-24/h6-7,9,11-12,15-16,18-21,26H,5,8,10,13-14,17,22H2,1-4H3,(H,31,34)/b7-6+