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

Systemtic Name: (2S)-2-[(4-chlorophenyl)sulfonylamino]-N-(1-cyclopropylpiperidin-1-ium-4-yl)-3-methyl-butanamide Openeye Name: (2S)-2-[(4-chlorophenyl)sulfonylamino]-N-(1-cyclopropylpiperidin-1-ium-4-yl)-3-methyl-butanamide CAS Name: (2S)-2-[(4-chlorophenyl)sulfonylamino]-N-(1-cyclopropyl-4-piperidin-1-iumyl)-3-methylbutanamide IUPAC Name: (2S)-2-[(4-chlorophenyl)sulfonylamino]-N-(1-cyclopropylpiperidin-1-ium-4-yl)-3-methylbutanamide Traditional Name: (2S)-2-[(4-chlorophenyl)sulfonylamino]-N-(1-cyclopropylpiperidin-1-ium-4-yl)-3-methyl-butyramide Formula: C19H29ClN3O3S+ MolecularWeight: 414.96986

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC1CC[NH+](CC1)C2CC2)NS(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC(C)[C@@H](C(=O)NC1CC[NH+](CC1)C2CC2)NS(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C19H28ClN3O3S/c1-13(2)18(22-27(25,26)17-7-3-14(20)4-8-17)19(24)21-15-9-11-23(12-10-15)16-5-6-16/h3-4,7-8,13,15-16,18,22H,5-6,9-12H2,1-2H3,(H,21,24)/p+1/t18-/m0/s1