N-[1-[(2-methoxy-5-methyl-phenyl)methyl]piperidin-1-ium-4-yl]thiophene-2-sulfonamide

Systemtic Name: N-[1-[(2-methoxy-5-methyl-phenyl)methyl]piperidin-1-ium-4-yl]thiophene-2-sulfonamide Openeye Name: N-[1-[(2-methoxy-5-methyl-phenyl)methyl]piperidin-1-ium-4-yl]thiophene-2-sulfonamide CAS Name: N-[1-[(2-methoxy-5-methylphenyl)methyl]-4-piperidin-1-iumyl]-2-thiophenesulfonamide IUPAC Name: N-[1-[(2-methoxy-5-methylphenyl)methyl]piperidin-1-ium-4-yl]thiophene-2-sulfonamide Traditional Name: N-[1-(2-methoxy-5-methyl-benzyl)piperidin-1-ium-4-yl]thiophene-2-sulfonamide Formula: C18H25N2O3S2+ MolecularWeight: 381.5327

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)C[NH+]2CCC(CC2)NS(=O)(=O)C3=CC=CS3

Isomeric SMILES

CC1=CC(=C(C=C1)OC)C[NH+]2CCC(CC2)NS(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C18H24N2O3S2/c1-14-5-6-17(23-2)15(12-14)13-20-9-7-16(8-10-20)19-25(21,22)18-4-3-11-24-18/h3-6,11-12,16,19H,7-10,13H2,1-2H3/p+1