4-methoxy-3-methyl-N-[(1-propan-2-ylpiperidin-1-ium-4-yl)methyl]benzenesulfonamide

Systemtic Name: 4-methoxy-3-methyl-N-[(1-propan-2-ylpiperidin-1-ium-4-yl)methyl]benzenesulfonamide Openeye Name: N-[(1-isopropylpiperidin-1-ium-4-yl)methyl]-4-methoxy-3-methyl-benzenesulfonamide CAS Name: 4-methoxy-3-methyl-N-[(1-propan-2-yl-4-piperidin-1-iumyl)methyl]benzenesulfonamide IUPAC Name: 4-methoxy-3-methyl-N-[(1-propan-2-ylpiperidin-1-ium-4-yl)methyl]benzenesulfonamide Traditional Name: N-[(1-isopropylpiperidin-1-ium-4-yl)methyl]-4-methoxy-3-methyl-benzenesulfonamide Formula: C17H29N2O3S+ MolecularWeight: 341.48876

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)S(=O)(=O)NCC2CC[NH+](CC2)C(C)C)OC

Isomeric SMILES

CC1=C(C=CC(=C1)S(=O)(=O)NCC2CC[NH+](CC2)C(C)C)OC

InChI

InChI=1S/C17H28N2O3S/c1-13(2)19-9-7-15(8-10-19)12-18-23(20,21)16-5-6-17(22-4)14(3)11-16/h5-6,11,13,15,18H,7-10,12H2,1-4H3/p+1