[(1S)-2-(dimethylamino)-2-oxidanylidene-1-phenyl-ethyl]-(4-methoxy-3-morpholin-4-ylsulfonyl-phenyl)azanium

Systemtic Name: [(1S)-2-(dimethylamino)-2-oxidanylidene-1-phenyl-ethyl]-(4-methoxy-3-morpholin-4-ylsulfonyl-phenyl)azanium Openeye Name: [(1S)-2-(dimethylamino)-2-oxo-1-phenyl-ethyl]-(4-methoxy-3-morpholinosulfonyl-phenyl)ammonium CAS Name: [(1S)-2-(dimethylamino)-2-oxo-1-phenylethyl]-[4-methoxy-3-(4-morpholinylsulfonyl)phenyl]ammonium IUPAC Name: [(1S)-2-(dimethylamino)-2-oxo-1-phenylethyl]-(4-methoxy-3-morpholin-4-ylsulfonylphenyl)azanium Traditional Name: [(1S)-2-(dimethylamino)-2-keto-1-phenyl-ethyl]-(4-methoxy-3-morpholinosulfonyl-phenyl)ammonium Formula: C21H28N3O5S+ MolecularWeight: 434.52912

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)C(C1=CC=CC=C1)[NH2+]C2=CC(=C(C=C2)OC)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CN(C)C(=O)[C@H](C1=CC=CC=C1)[NH2+]C2=CC(=C(C=C2)OC)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C21H27N3O5S/c1-23(2)21(25)20(16-7-5-4-6-8-16)22-17-9-10-18(28-3)19(15-17)30(26,27)24-11-13-29-14-12-24/h4-10,15,20,22H,11-14H2,1-3H3/p+1/t20-/m0/s1