ethyl-[2-oxidanylidene-2-[(4-phenyldiazenylphenyl)amino]ethyl]-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]azanium

Systemtic Name: ethyl-[2-oxidanylidene-2-[(4-phenyldiazenylphenyl)amino]ethyl]-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]azanium Openeye Name: ethyl-[2-(isopropylamino)-2-oxo-ethyl]-[2-oxo-2-(4-phenylazoanilino)ethyl]ammonium CAS Name: ethyl-[2-oxo-2-(4-phenyldiazenylanilino)ethyl]-[2-oxo-2-(propan-2-ylamino)ethyl]ammonium IUPAC Name: ethyl-[2-oxo-2-(4-phenyldiazenylanilino)ethyl]-[2-oxo-2-(propan-2-ylamino)ethyl]azanium Traditional Name: ethyl-[2-(isopropylamino)-2-keto-ethyl]-[2-keto-2-(4-phenylazoanilino)ethyl]ammonium Formula: C21H28N5O2+ MolecularWeight: 382.47932

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H27N5O2/c1-4-26(14-20(27)22-16(2)3)15-21(28)23-17-10-12-19(13-11-17)25-24-18-8-6-5-7-9-18/h5-13,16H,4,14-15H2,1-3H3,(H,22,27)(H,23,28)/p+1