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

Systemtic Name: [[4-acetamido-5-oxidanylidene-1-phenyl-3-(phenylmethyl)pyrazol-4-yl]-phenyl-amino]-diethyl-methyl-azanium Openeye Name: (N-(4-acetamido-3-benzyl-5-oxo-1-phenyl-pyrazol-4-yl)anilino)-diethyl-methyl-ammonium CAS Name: (N-[4-acetamido-5-oxo-1-phenyl-3-(phenylmethyl)-4-pyrazolyl]anilino)-diethyl-methylammonium IUPAC Name: (N-(4-acetamido-3-benzyl-5-oxo-1-phenylpyrazol-4-yl)anilino)-diethyl-methylazanium Traditional Name: (N-(4-acetamido-3-benzyl-5-keto-1-phenyl-2-pyrazolin-4-yl)anilino)-diethyl-methyl-ammonium Formula: C29H34N5O2+ MolecularWeight: 484.61256

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[N+](C)(CC)N(C1=CC=CC=C1)C2(C(=NN(C2=O)C3=CC=CC=C3)CC4=CC=CC=C4)NC(=O)C

Isomeric SMILES

CC[N+](C)(CC)N(C1=CC=CC=C1)C2(C(=NN(C2=O)C3=CC=CC=C3)CC4=CC=CC=C4)NC(=O)C

InChI

InChI=1S/C29H33N5O2/c1-5-34(4,6-2)33(26-20-14-9-15-21-26)29(30-23(3)35)27(22-24-16-10-7-11-17-24)31-32(28(29)36)25-18-12-8-13-19-25/h7-21H,5-6,22H2,1-4H3/p+1