1-(3,4-dichlorophenyl)carbonyl-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)piperidine-3-carboxamide

Systemtic Name: 1-(3,4-dichlorophenyl)carbonyl-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)piperidine-3-carboxamide Openeye Name: 1-(3,4-dichlorobenzoyl)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)piperidine-3-carboxamide CAS Name: 1-[(3,4-dichlorophenyl)-oxomethyl]-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-piperidinecarboxamide IUPAC Name: 1-(3,4-dichlorobenzoyl)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)piperidine-3-carboxamide Traditional Name: 1-(3,4-dichlorobenzoyl)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)nipecotamide Formula: C22H22Cl2N2O4 MolecularWeight: 449.32708

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)C2=CC(=C(C=C2)Cl)Cl)C(=O)NC3=CC4=C(C=C3)OCCCO4

Isomeric SMILES

C1CC(CN(C1)C(=O)C2=CC(=C(C=C2)Cl)Cl)C(=O)NC3=CC4=C(C=C3)OCCCO4

InChI

InChI=1S/C22H22Cl2N2O4/c23-17-6-4-14(11-18(17)24)22(28)26-8-1-3-15(13-26)21(27)25-16-5-7-19-20(12-16)30-10-2-9-29-19/h4-7,11-12,15H,1-3,8-10,13H2,(H,25,27)