[(4-acetamido-3-naphthalen-1-yl-5-oxidanylidene-1-phenyl-pyrazol-4-yl)-phenyl-amino]-ethoxy-diethyl-azanium

Systemtic Name: [(4-acetamido-3-naphthalen-1-yl-5-oxidanylidene-1-phenyl-pyrazol-4-yl)-phenyl-amino]-ethoxy-diethyl-azanium Openeye Name: (N-[4-acetamido-3-(1-naphthyl)-5-oxo-1-phenyl-pyrazol-4-yl]anilino)-ethoxy-diethyl-ammonium CAS Name: (N-[4-acetamido-3-(1-naphthalenyl)-5-oxo-1-phenyl-4-pyrazolyl]anilino)-ethoxy-diethylammonium IUPAC Name: (N-(4-acetamido-3-naphthalen-1-yl-5-oxo-1-phenylpyrazol-4-yl)anilino)-ethoxy-diethylazanium Traditional Name: (N-[4-acetamido-5-keto-3-(1-naphthyl)-1-phenyl-2-pyrazolin-4-yl]anilino)-ethoxy-diethyl-ammonium Formula: C33H36N5O3+ MolecularWeight: 550.67064

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+](CC)(N(C1=CC=CC=C1)C2(C(=NN(C2=O)C3=CC=CC=C3)C4=CC=CC5=CC=CC=C54)NC(=O)C)OCC

Isomeric SMILES

CC[N+](CC)(N(C1=CC=CC=C1)C2(C(=NN(C2=O)C3=CC=CC=C3)C4=CC=CC5=CC=CC=C54)NC(=O)C)OCC

InChI

InChI=1S/C33H35N5O3/c1-5-38(6-2,41-7-3)37(28-21-12-9-13-22-28)33(34-25(4)39)31(30-24-16-18-26-17-14-15-23-29(26)30)35-36(32(33)40)27-19-10-8-11-20-27/h8-24H,5-7H2,1-4H3/p+1