(2S,6S)-2,6-dimethyl-N-[1-(phenylmethyl)piperidin-1-ium-4-yl]morpholine-4-sulfonamide

Systemtic Name: (2S,6S)-2,6-dimethyl-N-[1-(phenylmethyl)piperidin-1-ium-4-yl]morpholine-4-sulfonamide Openeye Name: (2S,6S)-N-(1-benzylpiperidin-1-ium-4-yl)-2,6-dimethyl-morpholine-4-sulfonamide CAS Name: (2S,6S)-2,6-dimethyl-N-[1-(phenylmethyl)-4-piperidin-1-iumyl]-4-morpholinesulfonamide IUPAC Name: (2S,6S)-N-(1-benzylpiperidin-1-ium-4-yl)-2,6-dimethylmorpholine-4-sulfonamide Traditional Name: (2S,6S)-N-(1-benzylpiperidin-1-ium-4-yl)-2,6-dimethyl-morpholine-4-sulfonamide Formula: C18H30N3O3S+ MolecularWeight: 368.5141

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(O1)C)S(=O)(=O)NC2CC[NH+](CC2)CC3=CC=CC=C3

Isomeric SMILES

C[C@H]1CN(C[C@@H](O1)C)S(=O)(=O)NC2CC[NH+](CC2)CC3=CC=CC=C3

InChI

InChI=1S/C18H29N3O3S/c1-15-12-21(13-16(2)24-15)25(22,23)19-18-8-10-20(11-9-18)14-17-6-4-3-5-7-17/h3-7,15-16,18-19H,8-14H2,1-2H3/p+1/t15-,16-/m0/s1