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

Systemtic Name: 6-chloranyl-N-[2-(diethylamino)-3-methyl-butyl]-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxamide Openeye Name: 6-chloro-N-[2-(diethylamino)-3-methyl-butyl]-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxamide CAS Name: 6-chloro-N-[2-(diethylamino)-3-methylbutyl]-3,4-dihydro-2H-1,5-benzodioxepin-8-carboxamide IUPAC Name: 6-chloro-N-[2-(diethylamino)-3-methylbutyl]-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxamide Traditional Name: 6-chloro-N-[2-(diethylamino)-3-methyl-butyl]-3,4-dihydro-2H-1,5-benzodioxepin-8-carboxamide Formula: C19H29ClN2O3 MolecularWeight: 368.89816

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(CNC(=O)C1=CC2=C(C(=C1)Cl)OCCCO2)C(C)C

Isomeric SMILES

CCN(CC)C(CNC(=O)C1=CC2=C(C(=C1)Cl)OCCCO2)C(C)C

InChI

InChI=1S/C19H29ClN2O3/c1-5-22(6-2)16(13(3)4)12-21-19(23)14-10-15(20)18-17(11-14)24-8-7-9-25-18/h10-11,13,16H,5-9,12H2,1-4H3,(H,21,23)