ethyl 1-[(7-chloranyl-1,3-benzodioxol-5-yl)carbonyl]piperidine-3-carboxylate

Systemtic Name: ethyl 1-[(7-chloranyl-1,3-benzodioxol-5-yl)carbonyl]piperidine-3-carboxylate Openeye Name: ethyl 1-(7-chloro-1,3-benzodioxole-5-carbonyl)piperidine-3-carboxylate CAS Name: 1-[(7-chloro-1,3-benzodioxol-5-yl)-oxomethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(7-chloro-1,3-benzodioxole-5-carbonyl)piperidine-3-carboxylate Traditional Name: 1-(7-chloropiperonyloyl)nipecotic acid ethyl ester Formula: C16H18ClNO5 MolecularWeight: 339.77082

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)C2=CC3=C(C(=C2)Cl)OCO3

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C(=O)C2=CC3=C(C(=C2)Cl)OCO3

InChI

InChI=1S/C16H18ClNO5/c1-2-21-16(20)10-4-3-5-18(8-10)15(19)11-6-12(17)14-13(7-11)22-9-23-14/h6-7,10H,2-5,8-9H2,1H3