1-[(6-ethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-(2-fluorophenyl)-1-(2-morpholin-4-ium-4-ylethyl)urea

Systemtic Name: 1-[(6-ethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-(2-fluorophenyl)-1-(2-morpholin-4-ium-4-ylethyl)urea Openeye Name: 1-[(6-ethyl-2-oxo-1H-quinolin-3-yl)methyl]-3-(2-fluorophenyl)-1-(2-morpholin-4-ium-4-ylethyl)urea CAS Name: 1-[(6-ethyl-2-oxo-1H-quinolin-3-yl)methyl]-3-(2-fluorophenyl)-1-[2-(4-morpholin-4-iumyl)ethyl]urea IUPAC Name: 1-[(6-ethyl-2-oxo-1H-quinolin-3-yl)methyl]-3-(2-fluorophenyl)-1-(2-morpholin-4-ium-4-ylethyl)urea Traditional Name: 1-[(6-ethyl-2-keto-1H-quinolin-3-yl)methyl]-3-(2-fluorophenyl)-1-(2-morpholin-4-ium-4-ylethyl)urea Formula: C25H30FN4O3+ MolecularWeight: 453.529103

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)NC(=O)C(=C2)CN(CC[NH+]3CCOCC3)C(=O)NC4=CC=CC=C4F

Isomeric SMILES

CCC1=CC2=C(C=C1)NC(=O)C(=C2)CN(CC[NH+]3CCOCC3)C(=O)NC4=CC=CC=C4F

InChI

InChI=1S/C25H29FN4O3/c1-2-18-7-8-22-19(15-18)16-20(24(31)27-22)17-30(10-9-29-11-13-33-14-12-29)25(32)28-23-6-4-3-5-21(23)26/h3-8,15-16H,2,9-14,17H2,1H3,(H,27,31)(H,28,32)/p+1