diethyl-[3-[(3-pyrrolidin-1-ylsulfonylphenyl)carbonylamino]propyl]azanium

Systemtic Name: diethyl-[3-[(3-pyrrolidin-1-ylsulfonylphenyl)carbonylamino]propyl]azanium Openeye Name: diethyl-[3-[(3-pyrrolidin-1-ylsulfonylbenzoyl)amino]propyl]ammonium CAS Name: diethyl-[3-[[oxo-[3-(1-pyrrolidinylsulfonyl)phenyl]methyl]amino]propyl]ammonium IUPAC Name: diethyl-[3-[(3-pyrrolidin-1-ylsulfonylbenzoyl)amino]propyl]azanium Traditional Name: diethyl-[3-[(3-pyrrolidinosulfonylbenzoyl)amino]propyl]ammonium Formula: C18H30N3O3S+ MolecularWeight: 368.5141

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCCNC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCCC2

Isomeric SMILES

CC[NH+](CC)CCCNC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCCC2

InChI

InChI=1S/C18H29N3O3S/c1-3-20(4-2)12-8-11-19-18(22)16-9-7-10-17(15-16)25(23,24)21-13-5-6-14-21/h7,9-10,15H,3-6,8,11-14H2,1-2H3,(H,19,22)/p+1