methyl-[(3-morpholin-4-ylsulfonylphenyl)methyl]-[2-oxidanylidene-2-(propylamino)ethyl]azanium

Systemtic Name: methyl-[(3-morpholin-4-ylsulfonylphenyl)methyl]-[2-oxidanylidene-2-(propylamino)ethyl]azanium Openeye Name: methyl-[(3-morpholinosulfonylphenyl)methyl]-[2-oxo-2-(propylamino)ethyl]ammonium CAS Name: methyl-[[3-(4-morpholinylsulfonyl)phenyl]methyl]-[2-oxo-2-(propylamino)ethyl]ammonium IUPAC Name: methyl-[(3-morpholin-4-ylsulfonylphenyl)methyl]-[2-oxo-2-(propylamino)ethyl]azanium Traditional Name: [2-keto-2-(propylamino)ethyl]-methyl-(3-morpholinosulfonylbenzyl)ammonium Formula: C17H28N3O4S+ MolecularWeight: 370.48692

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C[NH+](C)CC1=CC(=CC=C1)S(=O)(=O)N2CCOCC2

Isomeric SMILES

CCCNC(=O)C[NH+](C)CC1=CC(=CC=C1)S(=O)(=O)N2CCOCC2

InChI

InChI=1S/C17H27N3O4S/c1-3-7-18-17(21)14-19(2)13-15-5-4-6-16(12-15)25(22,23)20-8-10-24-11-9-20/h4-6,12H,3,7-11,13-14H2,1-2H3,(H,18,21)/p+1