N-[(E,1R,4S)-2-bromanyl-4-(2-methoxyethoxymethoxy)-1-phenyl-pent-2-enyl]-4-(dimethylamino)benzenesulfonamide

Systemtic Name: N-[(E,1R,4S)-2-bromanyl-4-(2-methoxyethoxymethoxy)-1-phenyl-pent-2-enyl]-4-(dimethylamino)benzenesulfonamide Openeye Name: N-[(E,1R,4S)-2-bromo-4-(2-methoxyethoxymethoxy)-1-phenyl-pent-2-enyl]-4-(dimethylamino)benzenesulfonamide CAS Name: N-[(E,1R,4S)-2-bromo-4-(2-methoxyethoxymethoxy)-1-phenylpent-2-enyl]-4-(dimethylamino)benzenesulfonamide IUPAC Name: N-[(E,1R,4S)-2-bromo-4-(2-methoxyethoxymethoxy)-1-phenylpent-2-enyl]-4-(dimethylamino)benzenesulfonamide Traditional Name: N-[(E,1R,4S)-2-bromo-4-(2-methoxyethoxymethoxy)-1-phenyl-pent-2-enyl]-4-(dimethylamino)benzenesulfonamide Formula: C23H31BrN2O5S MolecularWeight: 527.47164

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C=C(C(C1=CC=CC=C1)NS(=O)(=O)C2=CC=C(C=C2)N(C)C)Br)OCOCCOC

Isomeric SMILES

C[C@@H](/C=C(\[C@@H](C1=CC=CC=C1)NS(=O)(=O)C2=CC=C(C=C2)N(C)C)/Br)OCOCCOC

InChI

InChI=1S/C23H31BrN2O5S/c1-18(31-17-30-15-14-29-4)16-22(24)23(19-8-6-5-7-9-19)25-32(27,28)21-12-10-20(11-13-21)26(2)3/h5-13,16,18,23,25H,14-15,17H2,1-4H3/b22-16+/t18-,23+/m0/s1