[4-ethoxycarbonyl-2-(1-methyl-2-oxidanylidene-quinolin-4-yl)pyrazol-3-yl]methyl-methyl-(2-pyrazol-1-ylethyl)azanium

Systemtic Name: [4-ethoxycarbonyl-2-(1-methyl-2-oxidanylidene-quinolin-4-yl)pyrazol-3-yl]methyl-methyl-(2-pyrazol-1-ylethyl)azanium Openeye Name: [4-ethoxycarbonyl-2-(1-methyl-2-oxo-4-quinolyl)pyrazol-3-yl]methyl-methyl-(2-pyrazol-1-ylethyl)ammonium CAS Name: [4-ethoxycarbonyl-2-(1-methyl-2-oxo-4-quinolinyl)-3-pyrazolyl]methyl-methyl-[2-(1-pyrazolyl)ethyl]ammonium IUPAC Name: [4-ethoxycarbonyl-2-(1-methyl-2-oxoquinolin-4-yl)pyrazol-3-yl]methyl-methyl-(2-pyrazol-1-ylethyl)azanium Traditional Name: [4-carbethoxy-2-(2-keto-1-methyl-4-quinolyl)pyrazol-3-yl]methyl-methyl-(2-pyrazol-1-ylethyl)ammonium Formula: C23H27N6O3+ MolecularWeight: 435.49888

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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[NH+](C)CCN4C=CC=N4

Isomeric SMILES

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

InChI

InChI=1S/C23H26N6O3/c1-4-32-23(31)18-15-25-29(21(18)16-26(2)12-13-28-11-7-10-24-28)20-14-22(30)27(3)19-9-6-5-8-17(19)20/h5-11,14-15H,4,12-13,16H2,1-3H3/p+1