(2R)-2-(1,3-benzodioxol-5-yl)-4-(4-chlorophenyl)-1-pyridin-3-yl-butane-1,4-dione

Systemtic Name: (2R)-2-(1,3-benzodioxol-5-yl)-4-(4-chlorophenyl)-1-pyridin-3-yl-butane-1,4-dione Openeye Name: (2R)-2-(1,3-benzodioxol-5-yl)-4-(4-chlorophenyl)-1-(3-pyridyl)butane-1,4-dione CAS Name: (2R)-2-(1,3-benzodioxol-5-yl)-4-(4-chlorophenyl)-1-(3-pyridinyl)butane-1,4-dione IUPAC Name: (2R)-2-(1,3-benzodioxol-5-yl)-4-(4-chlorophenyl)-1-pyridin-3-ylbutane-1,4-dione Traditional Name: (2R)-2-(1,3-benzodioxol-5-yl)-4-(4-chlorophenyl)-1-(3-pyridyl)butane-1,4-dione Formula: C22H16ClNO4 MolecularWeight: 393.81974

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(CC(=O)C3=CC=C(C=C3)Cl)C(=O)C4=CN=CC=C4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)[C@@H](CC(=O)C3=CC=C(C=C3)Cl)C(=O)C4=CN=CC=C4

InChI

InChI=1S/C22H16ClNO4/c23-17-6-3-14(4-7-17)19(25)11-18(22(26)16-2-1-9-24-12-16)15-5-8-20-21(10-15)28-13-27-20/h1-10,12,18H,11,13H2/t18-/m1/s1