2-ethyl-8-[(2-fluoranyl-5-methoxy-phenyl)methyl]-4-phenethyl-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione

Systemtic Name: 2-ethyl-8-[(2-fluoranyl-5-methoxy-phenyl)methyl]-4-phenethyl-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione Openeye Name: 2-ethyl-8-[(2-fluoro-5-methoxy-phenyl)methyl]-4-phenethyl-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione CAS Name: 2-ethyl-8-[(2-fluoro-5-methoxyphenyl)methyl]-4-phenethyl-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione IUPAC Name: 2-ethyl-8-[(2-fluoro-5-methoxyphenyl)methyl]-4-phenethyl-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione Traditional Name: 2-ethyl-8-(2-fluoro-5-methoxy-benzyl)-4-phenethyl-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-quinone Formula: C25H31FN3O3+ MolecularWeight: 440.530343

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2(CC[NH+](CC2)CC3=C(C=CC(=C3)OC)F)N(C1=O)CCC4=CC=CC=C4

Isomeric SMILES

CCN1C(=O)C2(CC[NH+](CC2)CC3=C(C=CC(=C3)OC)F)N(C1=O)CCC4=CC=CC=C4

InChI

InChI=1S/C25H30FN3O3/c1-3-28-23(30)25(29(24(28)31)14-11-19-7-5-4-6-8-19)12-15-27(16-13-25)18-20-17-21(32-2)9-10-22(20)26/h4-10,17H,3,11-16,18H2,1-2H3/p+1