4-phenyl-1-(4,5,6,7-tetrahydro-1-benzothiophen-3-ylmethyl)piperidin-1-ium-4-ol

Systemtic Name: 4-phenyl-1-(4,5,6,7-tetrahydro-1-benzothiophen-3-ylmethyl)piperidin-1-ium-4-ol Openeye Name: 4-phenyl-1-(4,5,6,7-tetrahydrobenzothiophen-3-ylmethyl)piperidin-1-ium-4-ol CAS Name: 4-phenyl-1-(4,5,6,7-tetrahydro-1-benzothiophen-3-ylmethyl)-4-piperidin-1-iumol IUPAC Name: 4-phenyl-1-(4,5,6,7-tetrahydro-1-benzothiophen-3-ylmethyl)piperidin-1-ium-4-ol Traditional Name: 4-phenyl-1-(4,5,6,7-tetrahydrobenzothiophen-3-ylmethyl)piperidin-1-ium-4-ol Formula: C20H26NOS+ MolecularWeight: 328.49154

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=CS2)C[NH+]3CCC(CC3)(C4=CC=CC=C4)O

Isomeric SMILES

C1CCC2=C(C1)C(=CS2)C[NH+]3CCC(CC3)(C4=CC=CC=C4)O

InChI

InChI=1S/C20H25NOS/c22-20(17-6-2-1-3-7-17)10-12-21(13-11-20)14-16-15-23-19-9-5-4-8-18(16)19/h1-3,6-7,15,22H,4-5,8-14H2/p+1