N-methyl-5-morpholin-4-ylsulfonyl-N-[(4-propan-2-ylphenyl)methyl]pyridin-1-ium-2-amine

Systemtic Name: N-methyl-5-morpholin-4-ylsulfonyl-N-[(4-propan-2-ylphenyl)methyl]pyridin-1-ium-2-amine Openeye Name: N-[(4-isopropylphenyl)methyl]-N-methyl-5-morpholinosulfonyl-pyridin-1-ium-2-amine CAS Name: N-methyl-5-(4-morpholinylsulfonyl)-N-[(4-propan-2-ylphenyl)methyl]-2-pyridin-1-iumamine IUPAC Name: N-methyl-5-morpholin-4-ylsulfonyl-N-[(4-propan-2-ylphenyl)methyl]pyridin-1-ium-2-amine Traditional Name: (4-isopropylbenzyl)-methyl-(5-morpholinosulfonylpyridin-1-ium-2-yl)amine Formula: C20H28N3O3S+ MolecularWeight: 390.51962

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)CN(C)C2=[NH+]C=C(C=C2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CC(C)C1=CC=C(C=C1)CN(C)C2=[NH+]C=C(C=C2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C20H27N3O3S/c1-16(2)18-6-4-17(5-7-18)15-22(3)20-9-8-19(14-21-20)27(24,25)23-10-12-26-13-11-23/h4-9,14,16H,10-13,15H2,1-3H3/p+1