2-(3,5-dimethylpyrazol-1-yl)ethyl-[[4-ethoxycarbonyl-2-(1-methyl-2-oxidanylidene-quinolin-4-yl)pyrazol-3-yl]methyl]azanium

Systemtic Name: 2-(3,5-dimethylpyrazol-1-yl)ethyl-[[4-ethoxycarbonyl-2-(1-methyl-2-oxidanylidene-quinolin-4-yl)pyrazol-3-yl]methyl]azanium Openeye Name: 2-(3,5-dimethylpyrazol-1-yl)ethyl-[[4-ethoxycarbonyl-2-(1-methyl-2-oxo-4-quinolyl)pyrazol-3-yl]methyl]ammonium CAS Name: 2-(3,5-dimethyl-1-pyrazolyl)ethyl-[[4-ethoxycarbonyl-2-(1-methyl-2-oxo-4-quinolinyl)-3-pyrazolyl]methyl]ammonium IUPAC Name: 2-(3,5-dimethylpyrazol-1-yl)ethyl-[[4-ethoxycarbonyl-2-(1-methyl-2-oxoquinolin-4-yl)pyrazol-3-yl]methyl]azanium Traditional Name: [4-carbethoxy-2-(2-keto-1-methyl-4-quinolyl)pyrazol-3-yl]methyl-[2-(3,5-dimethylpyrazol-1-yl)ethyl]ammonium Formula: C24H29N6O3+ MolecularWeight: 449.52546

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=CC(=O)N(C3=CC=CC=C32)C)C[NH2+]CCN4C(=CC(=N4)C)C

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=CC(=O)N(C3=CC=CC=C32)C)C[NH2+]CCN4C(=CC(=N4)C)C

InChI

InChI=1S/C24H28N6O3/c1-5-33-24(32)19-14-26-30(21-13-23(31)28(4)20-9-7-6-8-18(20)21)22(19)15-25-10-11-29-17(3)12-16(2)27-29/h6-9,12-14,25H,5,10-11,15H2,1-4H3/p+1