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

Systemtic Name: [4-ethoxycarbonyl-2-(1-methyl-2-oxidanylidene-quinolin-4-yl)pyrazol-3-yl]methyl-[(5-methylfuran-2-yl)methyl]azanium Openeye Name: [4-ethoxycarbonyl-2-(1-methyl-2-oxo-4-quinolyl)pyrazol-3-yl]methyl-[(5-methyl-2-furyl)methyl]ammonium CAS Name: [4-ethoxycarbonyl-2-(1-methyl-2-oxo-4-quinolinyl)-3-pyrazolyl]methyl-[(5-methyl-2-furanyl)methyl]ammonium IUPAC Name: [4-ethoxycarbonyl-2-(1-methyl-2-oxoquinolin-4-yl)pyrazol-3-yl]methyl-[(5-methylfuran-2-yl)methyl]azanium Traditional Name: [4-carbethoxy-2-(2-keto-1-methyl-4-quinolyl)pyrazol-3-yl]methyl-[(5-methyl-2-furyl)methyl]ammonium Formula: C23H25N4O4+ MolecularWeight: 421.469

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=CC(=O)N(C3=CC=CC=C32)C)C[NH2+]CC4=CC=C(O4)C

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=CC(=O)N(C3=CC=CC=C32)C)C[NH2+]CC4=CC=C(O4)C

InChI

InChI=1S/C23H24N4O4/c1-4-30-23(29)18-13-25-27(21(18)14-24-12-16-10-9-15(2)31-16)20-11-22(28)26(3)19-8-6-5-7-17(19)20/h5-11,13,24H,4,12,14H2,1-3H3/p+1