4-[(2,3,4,5,6-pentamethylphenyl)methyl]thiomorpholin-4-ium

Systemtic Name: 4-[(2,3,4,5,6-pentamethylphenyl)methyl]thiomorpholin-4-ium Openeye Name: 4-[(2,3,4,5,6-pentamethylphenyl)methyl]thiomorpholin-4-ium CAS Name: 4-[(2,3,4,5,6-pentamethylphenyl)methyl]thiomorpholin-4-ium IUPAC Name: 4-[(2,3,4,5,6-pentamethylphenyl)methyl]thiomorpholin-4-ium Traditional Name: 4-(2,3,4,5,6-pentamethylbenzyl)thiomorpholin-4-ium Formula: C16H26NS+ MolecularWeight: 264.44934

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=C1C)C)C[NH+]2CCSCC2)C)C

Isomeric SMILES

CC1=C(C(=C(C(=C1C)C)C[NH+]2CCSCC2)C)C

InChI

InChI=1S/C16H25NS/c1-11-12(2)14(4)16(15(5)13(11)3)10-17-6-8-18-9-7-17/h6-10H2,1-5H3/p+1