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

Systemtic Name: [4-ethoxycarbonyl-2-(1-methyl-2-oxidanylidene-quinolin-4-yl)pyrazol-3-yl]methyl-[2-(1H-indol-3-yl)ethyl]azanium Openeye Name: [4-ethoxycarbonyl-2-(1-methyl-2-oxo-4-quinolyl)pyrazol-3-yl]methyl-[2-(1H-indol-3-yl)ethyl]ammonium CAS Name: [4-ethoxycarbonyl-2-(1-methyl-2-oxo-4-quinolinyl)-3-pyrazolyl]methyl-[2-(1H-indol-3-yl)ethyl]ammonium IUPAC Name: [4-ethoxycarbonyl-2-(1-methyl-2-oxoquinolin-4-yl)pyrazol-3-yl]methyl-[2-(1H-indol-3-yl)ethyl]azanium Traditional Name: [4-carbethoxy-2-(2-keto-1-methyl-4-quinolyl)pyrazol-3-yl]methyl-[2-(1H-indol-3-yl)ethyl]ammonium Formula: C27H28N5O3+ MolecularWeight: 470.54292

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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+]CCC4=CNC5=CC=CC=C54

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=CC(=O)N(C3=CC=CC=C32)C)C[NH2+]CCC4=CNC5=CC=CC=C54

InChI

InChI=1S/C27H27N5O3/c1-3-35-27(34)21-16-30-32(24-14-26(33)31(2)23-11-7-5-9-20(23)24)25(21)17-28-13-12-18-15-29-22-10-6-4-8-19(18)22/h4-11,14-16,28-29H,3,12-13,17H2,1-2H3/p+1