tert-butyl N-[(E)-1-(4-methoxyphenyl)-4-(4-nitrophenyl)but-3-enoxy]carbamate

Systemtic Name: tert-butyl N-[(E)-1-(4-methoxyphenyl)-4-(4-nitrophenyl)but-3-enoxy]carbamate Openeye Name: tert-butyl N-[(E)-1-(4-methoxyphenyl)-4-(4-nitrophenyl)but-3-enoxy]carbamate CAS Name: N-[(E)-1-(4-methoxyphenyl)-4-(4-nitrophenyl)but-3-enoxy]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(E)-1-(4-methoxyphenyl)-4-(4-nitrophenyl)but-3-enoxy]carbamate Traditional Name: N-[(E)-1-(4-methoxyphenyl)-4-(4-nitrophenyl)but-3-enoxy]carbamic acid tert-butyl ester Formula: C22H26N2O6 MolecularWeight: 414.45164

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NOC(CC=CC1=CC=C(C=C1)[N+](=O)[O-])C2=CC=C(C=C2)OC

Isomeric SMILES

CC(C)(C)OC(=O)NOC(C/C=C/C1=CC=C(C=C1)[N+](=O)[O-])C2=CC=C(C=C2)OC

InChI

InChI=1S/C22H26N2O6/c1-22(2,3)29-21(25)23-30-20(17-10-14-19(28-4)15-11-17)7-5-6-16-8-12-18(13-9-16)24(26)27/h5-6,8-15,20H,7H2,1-4H3,(H,23,25)/b6-5+