[2-[[4-[(4-acetamidophenyl)diazenyl]phenyl]amino]-2-oxidanylidene-ethyl]-triethyl-azanium methanoate

Systemtic Name: [2-[[4-[(4-acetamidophenyl)diazenyl]phenyl]amino]-2-oxidanylidene-ethyl]-triethyl-azanium methanoate Openeye Name: [2-[4-(4-acetamidophenyl)azoanilino]-2-oxo-ethyl]-triethyl-ammonium formate CAS Name: [2-[4-(4-acetamidophenyl)azoanilino]-2-oxoethyl]-triethylammonium formate IUPAC Name: [2-[4-[(4-acetamidophenyl)diazenyl]anilino]-2-oxoethyl]-triethylazanium formate Traditional Name: [2-[4-(4-acetamidophenyl)azoanilino]-2-keto-ethyl]-triethyl-ammonium formate Formula: C23H31N5O4 MolecularWeight: 441.52334

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+](CC)(CC)CC(=O)NC1=CC=C(C=C1)N=NC2=CC=C(C=C2)NC(=O)C.C(=O)[O-]

Isomeric SMILES

CC[N+](CC)(CC)CC(=O)NC1=CC=C(C=C1)N=NC2=CC=C(C=C2)NC(=O)C.C(=O)[O-]

InChI

InChI=1S/C22H29N5O2.CH2O2/c1-5-27(6-2,7-3)16-22(29)24-19-10-14-21(15-11-19)26-25-20-12-8-18(9-13-20)23-17(4)28;2-1-3/h8-15H,5-7,16H2,1-4H3,(H-,23,24,25,26,28,29);1H,(H,2,3)