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

Systemtic Name: [2-(ethoxycarbonylamino)-2-oxidanylidene-ethyl]-ethyl-[(3-morpholin-4-ylsulfonylphenyl)methyl]azanium Openeye Name: [2-(ethoxycarbonylamino)-2-oxo-ethyl]-ethyl-[(3-morpholinosulfonylphenyl)methyl]ammonium CAS Name: [2-(ethoxycarbonylamino)-2-oxoethyl]-ethyl-[[3-(4-morpholinylsulfonyl)phenyl]methyl]ammonium IUPAC Name: [2-(ethoxycarbonylamino)-2-oxoethyl]-ethyl-[(3-morpholin-4-ylsulfonylphenyl)methyl]azanium Traditional Name: [2-(carbethoxyamino)-2-keto-ethyl]-ethyl-(3-morpholinosulfonylbenzyl)ammonium Formula: C18H28N3O6S+ MolecularWeight: 414.49642

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC1=CC(=CC=C1)S(=O)(=O)N2CCOCC2)CC(=O)NC(=O)OCC

Isomeric SMILES

CC[NH+](CC1=CC(=CC=C1)S(=O)(=O)N2CCOCC2)CC(=O)NC(=O)OCC

InChI

InChI=1S/C18H27N3O6S/c1-3-20(14-17(22)19-18(23)27-4-2)13-15-6-5-7-16(12-15)28(24,25)21-8-10-26-11-9-21/h5-7,12H,3-4,8-11,13-14H2,1-2H3,(H,19,22,23)/p+1