ethyl 4-[bis(8-chloranyl-2,2-dimethyl-4-oxidanylidene-1,3-benzodioxin-6-yl)methylidene]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[bis(8-chloranyl-2,2-dimethyl-4-oxidanylidene-1,3-benzodioxin-6-yl)methylidene]piperidine-1-carboxylate Openeye Name: ethyl 4-[bis(8-chloro-2,2-dimethyl-4-oxo-1,3-benzodioxin-6-yl)methylene]piperidine-1-carboxylate CAS Name: 4-[bis(8-chloro-2,2-dimethyl-4-oxo-1,3-benzodioxin-6-yl)methylidene]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[bis(8-chloro-2,2-dimethyl-4-oxo-1,3-benzodioxin-6-yl)methylidene]piperidine-1-carboxylate Traditional Name: 4-[bis(8-chloro-4-keto-2,2-dimethyl-1,3-benzodioxin-6-yl)methylene]piperidine-1-carboxylic acid ethyl ester Formula: C29H29Cl2NO8 MolecularWeight: 590.44846

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(=C(C2=CC(=C3C(=C2)C(=O)OC(O3)(C)C)Cl)C4=CC(=C5C(=C4)C(=O)OC(O5)(C)C)Cl)CC1

Isomeric SMILES

CCOC(=O)N1CCC(=C(C2=CC(=C3C(=C2)C(=O)OC(O3)(C)C)Cl)C4=CC(=C5C(=C4)C(=O)OC(O5)(C)C)Cl)CC1

InChI

InChI=1S/C29H29Cl2NO8/c1-6-36-27(35)32-9-7-15(8-10-32)22(16-11-18-23(20(30)13-16)37-28(2,3)39-25(18)33)17-12-19-24(21(31)14-17)38-29(4,5)40-26(19)34/h11-14H,6-10H2,1-5H3