6-chloranyl-N-[(1-morpholin-4-ylcyclohexyl)methyl]-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxamide

Systemtic Name: 6-chloranyl-N-[(1-morpholin-4-ylcyclohexyl)methyl]-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxamide Openeye Name: 6-chloro-N-[(1-morpholinocyclohexyl)methyl]-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxamide CAS Name: 6-chloro-N-[[1-(4-morpholinyl)cyclohexyl]methyl]-3,4-dihydro-2H-1,5-benzodioxepin-8-carboxamide IUPAC Name: 6-chloro-N-[(1-morpholin-4-ylcyclohexyl)methyl]-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxamide Traditional Name: 6-chloro-N-[(1-morpholinocyclohexyl)methyl]-3,4-dihydro-2H-1,5-benzodioxepin-8-carboxamide Formula: C21H29ClN2O4 MolecularWeight: 408.91896

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(CNC(=O)C2=CC3=C(C(=C2)Cl)OCCCO3)N4CCOCC4

Isomeric SMILES

C1CCC(CC1)(CNC(=O)C2=CC3=C(C(=C2)Cl)OCCCO3)N4CCOCC4

InChI

InChI=1S/C21H29ClN2O4/c22-17-13-16(14-18-19(17)28-10-4-9-27-18)20(25)23-15-21(5-2-1-3-6-21)24-7-11-26-12-8-24/h13-14H,1-12,15H2,(H,23,25)