dimethyl-[(2S)-2-[(3-morpholin-4-ylsulfonylphenyl)carbonylamino]-2-phenyl-ethyl]azanium

Systemtic Name: dimethyl-[(2S)-2-[(3-morpholin-4-ylsulfonylphenyl)carbonylamino]-2-phenyl-ethyl]azanium Openeye Name: dimethyl-[(2S)-2-[(3-morpholinosulfonylbenzoyl)amino]-2-phenyl-ethyl]ammonium CAS Name: dimethyl-[(2S)-2-[[[3-(4-morpholinylsulfonyl)phenyl]-oxomethyl]amino]-2-phenylethyl]ammonium IUPAC Name: dimethyl-[(2S)-2-[(3-morpholin-4-ylsulfonylbenzoyl)amino]-2-phenylethyl]azanium Traditional Name: dimethyl-[(2S)-2-[(3-morpholinosulfonylbenzoyl)amino]-2-phenyl-ethyl]ammonium Formula: C21H28N3O4S+ MolecularWeight: 418.52972

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[NH+](C)C[C@H](C1=CC=CC=C1)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C21H27N3O4S/c1-23(2)16-20(17-7-4-3-5-8-17)22-21(25)18-9-6-10-19(15-18)29(26,27)24-11-13-28-14-12-24/h3-10,15,20H,11-14,16H2,1-2H3,(H,22,25)/p+1/t20-/m1/s1