[4-[5-aminocarbonyl-2,3-bis(chloranyl)-4-pyridin-3-yl-phenoxy]-3H-inden-1-yl] benzoate

Systemtic Name: [4-[5-aminocarbonyl-2,3-bis(chloranyl)-4-pyridin-3-yl-phenoxy]-3H-inden-1-yl] benzoate Openeye Name: [4-[5-carbamoyl-2,3-dichloro-4-(3-pyridyl)phenoxy]-3H-inden-1-yl] benzoate CAS Name: benzoic acid [4-[5-carbamoyl-2,3-dichloro-4-(3-pyridinyl)phenoxy]-3H-inden-1-yl] ester IUPAC Name: [4-(5-carbamoyl-2,3-dichloro-4-pyridin-3-ylphenoxy)-3H-inden-1-yl] benzoate Traditional Name: benzoic acid [4-[5-carbamoyl-2,3-dichloro-4-(3-pyridyl)phenoxy]-3H-inden-1-yl] ester Formula: C28H18Cl2N2O4 MolecularWeight: 517.35952

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Descriptors Computed from Structure

Canonical SMILES:

C1C=C(C2=C1C(=CC=C2)OC3=C(C(=C(C(=C3)C(=O)N)C4=CN=CC=C4)Cl)Cl)OC(=O)C5=CC=CC=C5

Isomeric SMILES

C1C=C(C2=C1C(=CC=C2)OC3=C(C(=C(C(=C3)C(=O)N)C4=CN=CC=C4)Cl)Cl)OC(=O)C5=CC=CC=C5

InChI

InChI=1S/C28H18Cl2N2O4/c29-25-23(14-20(27(31)33)24(26(25)30)17-8-5-13-32-15-17)35-21-10-4-9-18-19(21)11-12-22(18)36-28(34)16-6-2-1-3-7-16/h1-10,12-15H,11H2,(H2,31,33)