dimethyl 2-[[4-[2-cyanoethyl(ethyl)amino]phenyl]diazenyl]benzene-1,4-dicarboxylate

Systemtic Name: dimethyl 2-[[4-[2-cyanoethyl(ethyl)amino]phenyl]diazenyl]benzene-1,4-dicarboxylate Openeye Name: dimethyl 2-[4-[2-cyanoethyl(ethyl)amino]phenyl]azobenzene-1,4-dicarboxylate CAS Name: 2-[4-[2-cyanoethyl(ethyl)amino]phenyl]azobenzene-1,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-[[4-[2-cyanoethyl(ethyl)amino]phenyl]diazenyl]benzene-1,4-dicarboxylate Traditional Name: 2-[4-[2-cyanoethyl(ethyl)amino]phenyl]azobenzene-1,4-dicarboxylic acid dimethyl ester Formula: C21H22N4O4 MolecularWeight: 394.42378

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCC#N)C1=CC=C(C=C1)N=NC2=C(C=CC(=C2)C(=O)OC)C(=O)OC

Isomeric SMILES

CCN(CCC#N)C1=CC=C(C=C1)N=NC2=C(C=CC(=C2)C(=O)OC)C(=O)OC

InChI

InChI=1S/C21H22N4O4/c1-4-25(13-5-12-22)17-9-7-16(8-10-17)23-24-19-14-15(20(26)28-2)6-11-18(19)21(27)29-3/h6-11,14H,4-5,13H2,1-3H3