1-[(7-chloranyl-1,3-benzodioxol-5-yl)carbonyl]-N-(2-methoxyphenyl)piperidine-4-carboxamide

Systemtic Name: 1-[(7-chloranyl-1,3-benzodioxol-5-yl)carbonyl]-N-(2-methoxyphenyl)piperidine-4-carboxamide Openeye Name: 1-(7-chloro-1,3-benzodioxole-5-carbonyl)-N-(2-methoxyphenyl)piperidine-4-carboxamide CAS Name: 1-[(7-chloro-1,3-benzodioxol-5-yl)-oxomethyl]-N-(2-methoxyphenyl)-4-piperidinecarboxamide IUPAC Name: 1-(7-chloro-1,3-benzodioxole-5-carbonyl)-N-(2-methoxyphenyl)piperidine-4-carboxamide Traditional Name: 1-(7-chloropiperonyloyl)-N-(2-methoxyphenyl)isonipecotamide Formula: C21H21ClN2O5 MolecularWeight: 416.85484

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NC(=O)C2CCN(CC2)C(=O)C3=CC4=C(C(=C3)Cl)OCO4

Isomeric SMILES

COC1=CC=CC=C1NC(=O)C2CCN(CC2)C(=O)C3=CC4=C(C(=C3)Cl)OCO4

InChI

InChI=1S/C21H21ClN2O5/c1-27-17-5-3-2-4-16(17)23-20(25)13-6-8-24(9-7-13)21(26)14-10-15(22)19-18(11-14)28-12-29-19/h2-5,10-11,13H,6-9,12H2,1H3,(H,23,25)