tert-butyl-[3-[(4-methyl-3-piperidin-1-ylsulfonyl-phenyl)carbonylamino]propyl]azanium

Systemtic Name: tert-butyl-[3-[(4-methyl-3-piperidin-1-ylsulfonyl-phenyl)carbonylamino]propyl]azanium Openeye Name: tert-butyl-[3-[[4-methyl-3-(1-piperidylsulfonyl)benzoyl]amino]propyl]ammonium CAS Name: tert-butyl-[3-[[[4-methyl-3-(1-piperidinylsulfonyl)phenyl]-oxomethyl]amino]propyl]ammonium IUPAC Name: tert-butyl-[3-[(4-methyl-3-piperidin-1-ylsulfonylbenzoyl)amino]propyl]azanium Traditional Name: tert-butyl-[3-[(4-methyl-3-piperidinosulfonyl-benzoyl)amino]propyl]ammonium Formula: C20H34N3O3S+ MolecularWeight: 396.56726

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NCCC[NH2+]C(C)(C)C)S(=O)(=O)N2CCCCC2

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NCCC[NH2+]C(C)(C)C)S(=O)(=O)N2CCCCC2

InChI

InChI=1S/C20H33N3O3S/c1-16-9-10-17(19(24)21-11-8-12-22-20(2,3)4)15-18(16)27(25,26)23-13-6-5-7-14-23/h9-10,15,22H,5-8,11-14H2,1-4H3,(H,21,24)/p+1