2-[1-[(4-tert-butylphenyl)methyl]piperidin-1-ium-4-yl]-1,3-benzothiazole

Systemtic Name: 2-[1-[(4-tert-butylphenyl)methyl]piperidin-1-ium-4-yl]-1,3-benzothiazole Openeye Name: 2-[1-[(4-tert-butylphenyl)methyl]piperidin-1-ium-4-yl]-1,3-benzothiazole CAS Name: 2-[1-[(4-tert-butylphenyl)methyl]-4-piperidin-1-iumyl]-1,3-benzothiazole IUPAC Name: 2-[1-[(4-tert-butylphenyl)methyl]piperidin-1-ium-4-yl]-1,3-benzothiazole Traditional Name: 2-[1-(4-tert-butylbenzyl)piperidin-1-ium-4-yl]-1,3-benzothiazole Formula: C23H29N2S+ MolecularWeight: 365.55476

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C[NH+]2CCC(CC2)C3=NC4=CC=CC=C4S3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C[NH+]2CCC(CC2)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C23H28N2S/c1-23(2,3)19-10-8-17(9-11-19)16-25-14-12-18(13-15-25)22-24-20-6-4-5-7-21(20)26-22/h4-11,18H,12-16H2,1-3H3/p+1