3-[[4-(2-ethoxyphenyl)piperazin-1-ium-1-yl]methyl]-7-fluoranyl-1-[(3-methoxyphenyl)methyl]quinolin-2-one

Systemtic Name: 3-[[4-(2-ethoxyphenyl)piperazin-1-ium-1-yl]methyl]-7-fluoranyl-1-[(3-methoxyphenyl)methyl]quinolin-2-one Openeye Name: 3-[[4-(2-ethoxyphenyl)piperazin-1-ium-1-yl]methyl]-7-fluoro-1-[(3-methoxyphenyl)methyl]quinolin-2-one CAS Name: 3-[[4-(2-ethoxyphenyl)-1-piperazin-1-iumyl]methyl]-7-fluoro-1-[(3-methoxyphenyl)methyl]-2-quinolinone IUPAC Name: 3-[[4-(2-ethoxyphenyl)piperazin-1-ium-1-yl]methyl]-7-fluoro-1-[(3-methoxyphenyl)methyl]quinolin-2-one Traditional Name: 7-fluoro-1-m-anisyl-3-[(4-o-phenetylpiperazin-1-ium-1-yl)methyl]carbostyril Formula: C30H33FN3O3+ MolecularWeight: 502.599723

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N2CC[NH+](CC2)CC3=CC4=C(C=C(C=C4)F)N(C3=O)CC5=CC(=CC=C5)OC

Isomeric SMILES

CCOC1=CC=CC=C1N2CC[NH+](CC2)CC3=CC4=C(C=C(C=C4)F)N(C3=O)CC5=CC(=CC=C5)OC

InChI

InChI=1S/C30H32FN3O3/c1-3-37-29-10-5-4-9-27(29)33-15-13-32(14-16-33)21-24-18-23-11-12-25(31)19-28(23)34(30(24)35)20-22-7-6-8-26(17-22)36-2/h4-12,17-19H,3,13-16,20-21H2,1-2H3/p+1