ethyl-[2-[(4-methyl-3-morpholin-4-ylsulfonyl-phenyl)amino]-2-oxidanylidene-ethyl]-(phenylmethyl)azanium

Systemtic Name: ethyl-[2-[(4-methyl-3-morpholin-4-ylsulfonyl-phenyl)amino]-2-oxidanylidene-ethyl]-(phenylmethyl)azanium Openeye Name: benzyl-ethyl-[2-(4-methyl-3-morpholinosulfonyl-anilino)-2-oxo-ethyl]ammonium CAS Name: ethyl-[2-[4-methyl-3-(4-morpholinylsulfonyl)anilino]-2-oxoethyl]-(phenylmethyl)ammonium IUPAC Name: benzyl-ethyl-[2-(4-methyl-3-morpholin-4-ylsulfonylanilino)-2-oxoethyl]azanium Traditional Name: benzyl-ethyl-[2-keto-2-(4-methyl-3-morpholinosulfonyl-anilino)ethyl]ammonium Formula: C22H30N3O4S+ MolecularWeight: 432.5563

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC1=CC=CC=C1)CC(=O)NC2=CC(=C(C=C2)C)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CC[NH+](CC1=CC=CC=C1)CC(=O)NC2=CC(=C(C=C2)C)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C22H29N3O4S/c1-3-24(16-19-7-5-4-6-8-19)17-22(26)23-20-10-9-18(2)21(15-20)30(27,28)25-11-13-29-14-12-25/h4-10,15H,3,11-14,16-17H2,1-2H3,(H,23,26)/p+1