dimethyl-[(2R)-1-[(3-piperidin-1-ylsulfonylphenyl)carbonylamino]butan-2-yl]azanium

Systemtic Name: dimethyl-[(2R)-1-[(3-piperidin-1-ylsulfonylphenyl)carbonylamino]butan-2-yl]azanium Openeye Name: dimethyl-[(1R)-1-[[[3-(1-piperidylsulfonyl)benzoyl]amino]methyl]propyl]ammonium CAS Name: dimethyl-[(2R)-1-[[oxo-[3-(1-piperidinylsulfonyl)phenyl]methyl]amino]butan-2-yl]ammonium IUPAC Name: dimethyl-[(2R)-1-[(3-piperidin-1-ylsulfonylbenzoyl)amino]butan-2-yl]azanium Traditional Name: dimethyl-[(1R)-1-[[(3-piperidinosulfonylbenzoyl)amino]methyl]propyl]ammonium Formula: C18H30N3O3S+ MolecularWeight: 368.5141

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CNC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCCCC2)[NH+](C)C

Isomeric SMILES

CC[C@H](CNC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCCCC2)[NH+](C)C

InChI

InChI=1S/C18H29N3O3S/c1-4-16(20(2)3)14-19-18(22)15-9-8-10-17(13-15)25(23,24)21-11-6-5-7-12-21/h8-10,13,16H,4-7,11-12,14H2,1-3H3,(H,19,22)/p+1/t16-/m1/s1