3-[2-cyanoethyl-[4-[(4-nitrophenyl)diazenyl]phenyl]amino]-N-ethyl-propanamide

Systemtic Name: 3-[2-cyanoethyl-[4-[(4-nitrophenyl)diazenyl]phenyl]amino]-N-ethyl-propanamide Openeye Name: 3-[N-(2-cyanoethyl)-4-(4-nitrophenyl)azo-anilino]-N-ethyl-propanamide CAS Name: 3-[N-(2-cyanoethyl)-4-(4-nitrophenyl)azoanilino]-N-ethylpropanamide IUPAC Name: 3-[N-(2-cyanoethyl)-4-[(4-nitrophenyl)diazenyl]anilino]-N-ethylpropanamide Traditional Name: 3-[N-(2-cyanoethyl)-4-(4-nitrophenyl)azo-anilino]-N-ethyl-propionamide Formula: C20H22N6O3 MolecularWeight: 394.42708

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)CCN(CCC#N)C1=CC=C(C=C1)N=NC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCNC(=O)CCN(CCC#N)C1=CC=C(C=C1)N=NC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C20H22N6O3/c1-2-22-20(27)12-15-25(14-3-13-21)18-8-4-16(5-9-18)23-24-17-6-10-19(11-7-17)26(28)29/h4-11H,2-3,12,14-15H2,1H3,(H,22,27)