4-methyl-N-[2-[(1S)-1-morpholin-4-ium-4-yl-3-phenyl-prop-2-ynyl]phenyl]benzenesulfonamide

Systemtic Name: 4-methyl-N-[2-[(1S)-1-morpholin-4-ium-4-yl-3-phenyl-prop-2-ynyl]phenyl]benzenesulfonamide Openeye Name: 4-methyl-N-[2-[(1S)-1-morpholin-4-ium-4-yl-3-phenyl-prop-2-ynyl]phenyl]benzenesulfonamide CAS Name: 4-methyl-N-[2-[(1S)-1-(4-morpholin-4-iumyl)-3-phenylprop-2-ynyl]phenyl]benzenesulfonamide IUPAC Name: 4-methyl-N-[2-[(1S)-1-morpholin-4-ium-4-yl-3-phenylprop-2-ynyl]phenyl]benzenesulfonamide Traditional Name: 4-methyl-N-[2-[(1S)-1-morpholin-4-ium-4-yl-3-phenyl-prop-2-ynyl]phenyl]benzenesulfonamide Formula: C26H27N2O3S+ MolecularWeight: 447.56918

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC=C2C(C#CC3=CC=CC=C3)[NH+]4CCOCC4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC=C2[C@H](C#CC3=CC=CC=C3)[NH+]4CCOCC4

InChI

InChI=1S/C26H26N2O3S/c1-21-11-14-23(15-12-21)32(29,30)27-25-10-6-5-9-24(25)26(28-17-19-31-20-18-28)16-13-22-7-3-2-4-8-22/h2-12,14-15,26-27H,17-20H2,1H3/p+1/t26-/m0/s1