[(2R)-3-(2-chloranyl-4-morpholin-4-ylsulfonyl-phenoxy)-2-oxidanyl-propyl]-(phenylmethyl)-propan-2-yl-azanium

Systemtic Name: [(2R)-3-(2-chloranyl-4-morpholin-4-ylsulfonyl-phenoxy)-2-oxidanyl-propyl]-(phenylmethyl)-propan-2-yl-azanium Openeye Name: benzyl-[(2R)-3-(2-chloro-4-morpholinosulfonyl-phenoxy)-2-hydroxy-propyl]-isopropyl-ammonium CAS Name: [(2R)-3-[2-chloro-4-(4-morpholinylsulfonyl)phenoxy]-2-hydroxypropyl]-(phenylmethyl)-propan-2-ylammonium IUPAC Name: benzyl-[(2R)-3-(2-chloro-4-morpholin-4-ylsulfonylphenoxy)-2-hydroxypropyl]-propan-2-ylazanium Traditional Name: benzyl-[(2R)-3-(2-chloro-4-morpholinosulfonyl-phenoxy)-2-hydroxy-propyl]-isopropyl-ammonium Formula: C23H32ClN2O5S+ MolecularWeight: 484.02858

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+](CC1=CC=CC=C1)CC(COC2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)Cl)O

Isomeric SMILES

CC(C)[NH+](CC1=CC=CC=C1)C[C@H](COC2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)Cl)O

InChI

InChI=1S/C23H31ClN2O5S/c1-18(2)25(15-19-6-4-3-5-7-19)16-20(27)17-31-23-9-8-21(14-22(23)24)32(28,29)26-10-12-30-13-11-26/h3-9,14,18,20,27H,10-13,15-17H2,1-2H3/p+1/t20-/m1/s1