3-[(6-ethoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl-[(4-fluorophenyl)carbamoyl]amino]propyl-diethyl-azanium

Systemtic Name: 3-[(6-ethoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl-[(4-fluorophenyl)carbamoyl]amino]propyl-diethyl-azanium Openeye Name: 3-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl-[(4-fluorophenyl)carbamoyl]amino]propyl-diethyl-ammonium CAS Name: 3-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl-[(4-fluoroanilino)-oxomethyl]amino]propyl-diethylammonium IUPAC Name: 3-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl-[(4-fluorophenyl)carbamoyl]amino]propyl-diethylazanium Traditional Name: 3-[(6-ethoxy-2-keto-1H-quinolin-3-yl)methyl-[(4-fluorophenyl)carbamoyl]amino]propyl-diethyl-ammonium Formula: C26H34FN4O3+ MolecularWeight: 469.571563

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCCN(CC1=CC2=C(C=CC(=C2)OCC)NC1=O)C(=O)NC3=CC=C(C=C3)F

Isomeric SMILES

CC[NH+](CC)CCCN(CC1=CC2=C(C=CC(=C2)OCC)NC1=O)C(=O)NC3=CC=C(C=C3)F

InChI

InChI=1S/C26H33FN4O3/c1-4-30(5-2)14-7-15-31(26(33)28-22-10-8-21(27)9-11-22)18-20-16-19-17-23(34-6-3)12-13-24(19)29-25(20)32/h8-13,16-17H,4-7,14-15,18H2,1-3H3,(H,28,33)(H,29,32)/p+1