6-chloranyl-N-[3-(3-methylphenoxy)propyl]-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxamide

Systemtic Name: 6-chloranyl-N-[3-(3-methylphenoxy)propyl]-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxamide Openeye Name: 6-chloro-N-[3-(3-methylphenoxy)propyl]-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxamide CAS Name: 6-chloro-N-[3-(3-methylphenoxy)propyl]-3,4-dihydro-2H-1,5-benzodioxepin-8-carboxamide IUPAC Name: 6-chloro-N-[3-(3-methylphenoxy)propyl]-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxamide Traditional Name: 6-chloro-N-[3-(3-methylphenoxy)propyl]-3,4-dihydro-2H-1,5-benzodioxepin-8-carboxamide Formula: C20H22ClNO4 MolecularWeight: 375.84598

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCCNC(=O)C2=CC3=C(C(=C2)Cl)OCCCO3

Isomeric SMILES

CC1=CC(=CC=C1)OCCCNC(=O)C2=CC3=C(C(=C2)Cl)OCCCO3

InChI

InChI=1S/C20H22ClNO4/c1-14-5-2-6-16(11-14)24-8-3-7-22-20(23)15-12-17(21)19-18(13-15)25-9-4-10-26-19/h2,5-6,11-13H,3-4,7-10H2,1H3,(H,22,23)