(2S)-2-[(4-chlorophenyl)sulfonylamino]-3-methyl-N-(3-piperidin-1-ium-1-ylpropyl)butanamide

Systemtic Name: (2S)-2-[(4-chlorophenyl)sulfonylamino]-3-methyl-N-(3-piperidin-1-ium-1-ylpropyl)butanamide Openeye Name: (2S)-2-[(4-chlorophenyl)sulfonylamino]-3-methyl-N-(3-piperidin-1-ium-1-ylpropyl)butanamide CAS Name: (2S)-2-[(4-chlorophenyl)sulfonylamino]-3-methyl-N-[3-(1-piperidin-1-iumyl)propyl]butanamide IUPAC Name: (2S)-2-[(4-chlorophenyl)sulfonylamino]-3-methyl-N-(3-piperidin-1-ium-1-ylpropyl)butanamide Traditional Name: (2S)-2-[(4-chlorophenyl)sulfonylamino]-3-methyl-N-(3-piperidin-1-ium-1-ylpropyl)butyramide Formula: C19H31ClN3O3S+ MolecularWeight: 416.98574

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NCCC[NH+]1CCCCC1)NS(=O)(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CC(C)[C@@H](C(=O)NCCC[NH+]1CCCCC1)NS(=O)(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C19H30ClN3O3S/c1-15(2)18(22-27(25,26)17-9-7-16(20)8-10-17)19(24)21-11-6-14-23-12-4-3-5-13-23/h7-10,15,18,22H,3-6,11-14H2,1-2H3,(H,21,24)/p+1/t18-/m0/s1