N-[4-(4-chlorophenyl)-3-pyridin-3-yl-butan-2-yl]-3-methyl-2H-1,4-benzodioxine-3-carboxamide

Systemtic Name: N-[4-(4-chlorophenyl)-3-pyridin-3-yl-butan-2-yl]-3-methyl-2H-1,4-benzodioxine-3-carboxamide Openeye Name: N-[3-(4-chlorophenyl)-1-methyl-2-(3-pyridyl)propyl]-3-methyl-2H-1,4-benzodioxine-3-carboxamide CAS Name: N-[4-(4-chlorophenyl)-3-(3-pyridinyl)butan-2-yl]-3-methyl-2H-1,4-benzodioxin-3-carboxamide IUPAC Name: N-[4-(4-chlorophenyl)-3-pyridin-3-ylbutan-2-yl]-3-methyl-2H-1,4-benzodioxine-3-carboxamide Traditional Name: N-[3-(4-chlorophenyl)-1-methyl-2-(3-pyridyl)propyl]-3-methyl-2H-1,4-benzodioxin-3-carboxamide Formula: C25H25ClN2O3 MolecularWeight: 436.9306

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(CC1=CC=C(C=C1)Cl)C2=CN=CC=C2)NC(=O)C3(COC4=CC=CC=C4O3)C

Isomeric SMILES

CC(C(CC1=CC=C(C=C1)Cl)C2=CN=CC=C2)NC(=O)C3(COC4=CC=CC=C4O3)C

InChI

InChI=1S/C25H25ClN2O3/c1-17(28-24(29)25(2)16-30-22-7-3-4-8-23(22)31-25)21(19-6-5-13-27-15-19)14-18-9-11-20(26)12-10-18/h3-13,15,17,21H,14,16H2,1-2H3,(H,28,29)