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

Systemtic Name: 1-(5-chloranyl-2-methoxy-phenyl)carbonyl-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)piperidine-4-carboxamide Openeye Name: 1-(5-chloro-2-methoxy-benzoyl)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)piperidine-4-carboxamide CAS Name: 1-[(5-chloro-2-methoxyphenyl)-oxomethyl]-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-piperidinecarboxamide IUPAC Name: 1-(5-chloro-2-methoxybenzoyl)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)piperidine-4-carboxamide Traditional Name: 1-(5-chloro-2-methoxy-benzoyl)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)isonipecotamide Formula: C23H25ClN2O5 MolecularWeight: 444.908

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)C(=O)N2CCC(CC2)C(=O)NC3=CC4=C(C=C3)OCCCO4

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)C(=O)N2CCC(CC2)C(=O)NC3=CC4=C(C=C3)OCCCO4

InChI

InChI=1S/C23H25ClN2O5/c1-29-19-5-3-16(24)13-18(19)23(28)26-9-7-15(8-10-26)22(27)25-17-4-6-20-21(14-17)31-12-2-11-30-20/h3-6,13-15H,2,7-12H2,1H3,(H,25,27)