(2R,4S)-6-chloranyl-N-[3-(dimethylamino)propyl]-4-phenyl-4H-1,3-benzodioxine-2-carboxamide

Systemtic Name: (2R,4S)-6-chloranyl-N-[3-(dimethylamino)propyl]-4-phenyl-4H-1,3-benzodioxine-2-carboxamide Openeye Name: (2R,4S)-6-chloro-N-[3-(dimethylamino)propyl]-4-phenyl-4H-1,3-benzodioxine-2-carboxamide CAS Name: (2R,4S)-6-chloro-N-[3-(dimethylamino)propyl]-4-phenyl-4H-1,3-benzodioxin-2-carboxamide IUPAC Name: (2R,4S)-6-chloro-N-[3-(dimethylamino)propyl]-4-phenyl-4H-1,3-benzodioxine-2-carboxamide Traditional Name: (2R,4S)-6-chloro-N-[3-(dimethylamino)propyl]-4-phenyl-4H-1,3-benzodioxin-2-carboxamide Formula: C20H23ClN2O3 MolecularWeight: 374.86122

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCNC(=O)C1OC(C2=C(O1)C=CC(=C2)Cl)C3=CC=CC=C3

Isomeric SMILES

CN(C)CCCNC(=O)[C@@H]1O[C@H](C2=C(O1)C=CC(=C2)Cl)C3=CC=CC=C3

InChI

InChI=1S/C20H23ClN2O3/c1-23(2)12-6-11-22-19(24)20-25-17-10-9-15(21)13-16(17)18(26-20)14-7-4-3-5-8-14/h3-5,7-10,13,18,20H,6,11-12H2,1-2H3,(H,22,24)/t18-,20-/m0/s1