3-piperazin-4-ium-1-ylsulfonyl-N-(2-propan-2-ylphenyl)propanamide

Systemtic Name: 3-piperazin-4-ium-1-ylsulfonyl-N-(2-propan-2-ylphenyl)propanamide Openeye Name: N-(2-isopropylphenyl)-3-piperazin-4-ium-1-ylsulfonyl-propanamide CAS Name: 3-(1-piperazin-4-iumylsulfonyl)-N-(2-propan-2-ylphenyl)propanamide IUPAC Name: 3-piperazin-4-ium-1-ylsulfonyl-N-(2-propan-2-ylphenyl)propanamide Traditional Name: N-o-cumenyl-3-piperazin-4-ium-1-ylsulfonyl-propionamide Formula: C16H26N3O3S+ MolecularWeight: 340.46094

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1NC(=O)CCS(=O)(=O)N2CC[NH2+]CC2

Isomeric SMILES

CC(C)C1=CC=CC=C1NC(=O)CCS(=O)(=O)N2CC[NH2+]CC2

InChI

InChI=1S/C16H25N3O3S/c1-13(2)14-5-3-4-6-15(14)18-16(20)7-12-23(21,22)19-10-8-17-9-11-19/h3-6,13,17H,7-12H2,1-2H3,(H,18,20)/p+1