3,4-dihydro-1H-isoquinolin-2-ylsulfonyl-ethyl-[2-(ethylamino)-2-oxidanylidene-ethyl]azanium

Systemtic Name: 3,4-dihydro-1H-isoquinolin-2-ylsulfonyl-ethyl-[2-(ethylamino)-2-oxidanylidene-ethyl]azanium Openeye Name: 3,4-dihydro-1H-isoquinolin-2-ylsulfonyl-ethyl-[2-(ethylamino)-2-oxo-ethyl]ammonium CAS Name: 3,4-dihydro-1H-isoquinolin-2-ylsulfonyl-ethyl-[2-(ethylamino)-2-oxoethyl]ammonium IUPAC Name: 3,4-dihydro-1H-isoquinolin-2-ylsulfonyl-ethyl-[2-(ethylamino)-2-oxoethyl]azanium Traditional Name: 3,4-dihydro-1H-isoquinolin-2-ylsulfonyl-ethyl-[2-(ethylamino)-2-keto-ethyl]ammonium Formula: C15H24N3O3S+ MolecularWeight: 326.43436

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C[NH+](CC)S(=O)(=O)N1CCC2=CC=CC=C2C1

Isomeric SMILES

CCNC(=O)C[NH+](CC)S(=O)(=O)N1CCC2=CC=CC=C2C1

InChI

InChI=1S/C15H23N3O3S/c1-3-16-15(19)12-17(4-2)22(20,21)18-10-9-13-7-5-6-8-14(13)11-18/h5-8H,3-4,9-12H2,1-2H3,(H,16,19)/p+1