[5-[3-(5-chloranyl-2-phenylmethoxy-phenyl)thiophen-2-yl]pyridin-1-ium-3-yl]methanol

Systemtic Name: [5-[3-(5-chloranyl-2-phenylmethoxy-phenyl)thiophen-2-yl]pyridin-1-ium-3-yl]methanol Openeye Name: [5-[3-(2-benzyloxy-5-chloro-phenyl)-2-thienyl]pyridin-1-ium-3-yl]methanol CAS Name: [5-[3-(5-chloro-2-phenylmethoxyphenyl)-2-thiophenyl]-3-pyridin-1-iumyl]methanol IUPAC Name: [5-[3-(5-chloro-2-phenylmethoxyphenyl)thiophen-2-yl]pyridin-1-ium-3-yl]methanol Traditional Name: [5-[3-(2-benzoxy-5-chloro-phenyl)-2-thienyl]pyridin-1-ium-3-yl]methanol Formula: C23H19ClNO2S+ MolecularWeight: 408.92046

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=C(C=C(C=C2)Cl)C3=C(SC=C3)C4=CC(=C[NH+]=C4)CO

Isomeric SMILES

C1=CC=C(C=C1)COC2=C(C=C(C=C2)Cl)C3=C(SC=C3)C4=CC(=C[NH+]=C4)CO

InChI

InChI=1S/C23H18ClNO2S/c24-19-6-7-22(27-15-16-4-2-1-3-5-16)21(11-19)20-8-9-28-23(20)18-10-17(14-26)12-25-13-18/h1-13,26H,14-15H2/p+1