O1-(4-cyanophenyl) O4-(phenylmethyl) (Z)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-2-propoxy-but-2-enedioate

Systemtic Name: O1-(4-cyanophenyl) O4-(phenylmethyl) (Z)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-2-propoxy-but-2-enedioate Openeye Name: O1-benzyl O4-(4-cyanophenyl) (Z)-2-(tert-butoxycarbonylamino)-3-propoxy-but-2-enedioate CAS Name: (Z)-3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-2-propoxy-2-butenedioic acid O1-(4-cyanophenyl) ester O4-(phenylmethyl) ester IUPAC Name: 4-O-benzyl 1-O-(4-cyanophenyl) (Z)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-2-propoxybut-2-enedioate Traditional Name: (Z)-2-(tert-butoxycarbonylamino)-3-propoxy-but-2-enedioic acid O1-benzyl ester O4-(4-cyanophenyl) ester Formula: C26H28N2O7 MolecularWeight: 480.50972

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=C(C(=O)OCC1=CC=CC=C1)NC(=O)OC(C)(C)C)C(=O)OC2=CC=C(C=C2)C#N

Isomeric SMILES

CCCO/C(=C(/C(=O)OCC1=CC=CC=C1)\NC(=O)OC(C)(C)C)/C(=O)OC2=CC=C(C=C2)C#N

InChI

InChI=1S/C26H28N2O7/c1-5-15-32-22(24(30)34-20-13-11-18(16-27)12-14-20)21(28-25(31)35-26(2,3)4)23(29)33-17-19-9-7-6-8-10-19/h6-14H,5,15,17H2,1-4H3,(H,28,31)/b22-21-