5-phenoxy-2-(4-pyridin-1-ium-1-ylbutyl)indol-1-ide

Systemtic Name: 5-phenoxy-2-(4-pyridin-1-ium-1-ylbutyl)indol-1-ide Openeye Name: 5-phenoxy-2-(4-pyridin-1-ium-1-ylbutyl)indol-1-ide CAS Name: 5-phenoxy-2-[4-(1-pyridin-1-iumyl)butyl]indol-1-ide IUPAC Name: 5-phenoxy-2-(4-pyridin-1-ium-1-ylbutyl)indol-1-ide Traditional Name: 5-phenoxy-2-(4-pyridin-1-ium-1-ylbutyl)indol-1-ide Formula: C23H22N2O MolecularWeight: 342.43358

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC3=C(C=C2)[N-]C(=C3)CCCC[N+]4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC3=C(C=C2)[N-]C(=C3)CCCC[N+]4=CC=CC=C4

InChI

InChI=1S/C23H22N2O/c1-3-10-21(11-4-1)26-22-12-13-23-19(18-22)17-20(24-23)9-5-8-16-25-14-6-2-7-15-25/h1-4,6-7,10-15,17-18H,5,8-9,16H2