2-[[4-[(2,4-dicyanophenyl)diazenyl]phenyl]-methyl-amino]ethyl 2-ethyl-2-methyl-pentanoate

Systemtic Name: 2-[[4-[(2,4-dicyanophenyl)diazenyl]phenyl]-methyl-amino]ethyl 2-ethyl-2-methyl-pentanoate Openeye Name: 2-[4-(2,4-dicyanophenyl)azo-N-methyl-anilino]ethyl 2-ethyl-2-methyl-pentanoate CAS Name: 2-ethyl-2-methylpentanoic acid 2-[4-(2,4-dicyanophenyl)azo-N-methylanilino]ethyl ester IUPAC Name: 2-[4-[(2,4-dicyanophenyl)diazenyl]-N-methylanilino]ethyl 2-ethyl-2-methylpentanoate Traditional Name: 2-ethyl-2-methyl-valeric acid 2-[4-(2,4-dicyanophenyl)azo-N-methyl-anilino]ethyl ester Formula: C25H29N5O2 MolecularWeight: 431.53006

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)(CC)C(=O)OCCN(C)C1=CC=C(C=C1)N=NC2=C(C=C(C=C2)C#N)C#N

Isomeric SMILES

CCCC(C)(CC)C(=O)OCCN(C)C1=CC=C(C=C1)N=NC2=C(C=C(C=C2)C#N)C#N

InChI

InChI=1S/C25H29N5O2/c1-5-13-25(3,6-2)24(31)32-15-14-30(4)22-10-8-21(9-11-22)28-29-23-12-7-19(17-26)16-20(23)18-27/h7-12,16H,5-6,13-15H2,1-4H3