[2-[4-[[3-chloranyl-4-(2-cyanoethylamino)phenyl]diazenyl]phenyl]-2-oxidanylidene-ethyl]-trimethyl-azanium

Systemtic Name: [2-[4-[[3-chloranyl-4-(2-cyanoethylamino)phenyl]diazenyl]phenyl]-2-oxidanylidene-ethyl]-trimethyl-azanium Openeye Name: [2-[4-[3-chloro-4-(2-cyanoethylamino)phenyl]azophenyl]-2-oxo-ethyl]-trimethyl-ammonium CAS Name: [2-[4-[3-chloro-4-(2-cyanoethylamino)phenyl]azophenyl]-2-oxoethyl]-trimethylammonium IUPAC Name: [2-[4-[[3-chloro-4-(2-cyanoethylamino)phenyl]diazenyl]phenyl]-2-oxoethyl]-trimethylazanium Traditional Name: [2-[4-[3-chloro-4-(2-cyanoethylamino)phenyl]azophenyl]-2-keto-ethyl]-trimethyl-ammonium Formula: C20H23ClN5O+ MolecularWeight: 384.88252

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CC(=O)C1=CC=C(C=C1)N=NC2=CC(=C(C=C2)NCCC#N)Cl

Isomeric SMILES

C[N+](C)(C)CC(=O)C1=CC=C(C=C1)N=NC2=CC(=C(C=C2)NCCC#N)Cl

InChI

InChI=1S/C20H22ClN5O/c1-26(2,3)14-20(27)15-5-7-16(8-6-15)24-25-17-9-10-19(18(21)13-17)23-12-4-11-22/h5-10,13H,4,12,14H2,1-3H3/p+1