5-(dimethylamino)-N-[(2S)-2-oxidanyl-3-(4-prop-2-enoxyphenoxy)propyl]-N-propan-2-yl-naphthalene-1-sulfonamide

Systemtic Name: 5-(dimethylamino)-N-[(2S)-2-oxidanyl-3-(4-prop-2-enoxyphenoxy)propyl]-N-propan-2-yl-naphthalene-1-sulfonamide Openeye Name: N-[(2S)-3-(4-allyloxyphenoxy)-2-hydroxy-propyl]-5-(dimethylamino)-N-isopropyl-naphthalene-1-sulfonamide CAS Name: 5-(dimethylamino)-N-[(2S)-2-hydroxy-3-(4-prop-2-enoxyphenoxy)propyl]-N-propan-2-yl-1-naphthalenesulfonamide IUPAC Name: 5-(dimethylamino)-N-[(2S)-2-hydroxy-3-(4-prop-2-enoxyphenoxy)propyl]-N-propan-2-ylnaphthalene-1-sulfonamide Traditional Name: N-[(2S)-3-(4-allyloxyphenoxy)-2-hydroxy-propyl]-5-(dimethylamino)-N-isopropyl-naphthalene-1-sulfonamide Formula: C27H34N2O5S MolecularWeight: 498.63426

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CC(COC1=CC=C(C=C1)OCC=C)O)S(=O)(=O)C2=CC=CC3=C2C=CC=C3N(C)C

Isomeric SMILES

CC(C)N(C[C@@H](COC1=CC=C(C=C1)OCC=C)O)S(=O)(=O)C2=CC=CC3=C2C=CC=C3N(C)C

InChI

InChI=1S/C27H34N2O5S/c1-6-17-33-22-13-15-23(16-14-22)34-19-21(30)18-29(20(2)3)35(31,32)27-12-8-9-24-25(27)10-7-11-26(24)28(4)5/h6-16,20-21,30H,1,17-19H2,2-5H3/t21-/m0/s1