dimethyl-[2-[[3-[(4-methylphenyl)sulfonylamino]-4-piperidin-1-yl-phenyl]carbonylamino]ethyl]azanium

Systemtic Name: dimethyl-[2-[[3-[(4-methylphenyl)sulfonylamino]-4-piperidin-1-yl-phenyl]carbonylamino]ethyl]azanium Openeye Name: dimethyl-[2-[[4-(1-piperidyl)-3-(p-tolylsulfonylamino)benzoyl]amino]ethyl]ammonium CAS Name: dimethyl-[2-[[[3-[(4-methylphenyl)sulfonylamino]-4-(1-piperidinyl)phenyl]-oxomethyl]amino]ethyl]ammonium IUPAC Name: dimethyl-[2-[[3-[(4-methylphenyl)sulfonylamino]-4-piperidin-1-ylbenzoyl]amino]ethyl]azanium Traditional Name: dimethyl-[2-[[4-piperidino-3-(tosylamino)benzoyl]amino]ethyl]ammonium Formula: C23H33N4O3S+ MolecularWeight: 445.59812

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=C(C=CC(=C2)C(=O)NCC[NH+](C)C)N3CCCCC3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=C(C=CC(=C2)C(=O)NCC[NH+](C)C)N3CCCCC3

InChI

InChI=1S/C23H32N4O3S/c1-18-7-10-20(11-8-18)31(29,30)25-21-17-19(23(28)24-13-16-26(2)3)9-12-22(21)27-14-5-4-6-15-27/h7-12,17,25H,4-6,13-16H2,1-3H3,(H,24,28)/p+1