2-(4-chloranyl-2-methyl-phenoxy)-N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]propanamide

Systemtic Name: 2-(4-chloranyl-2-methyl-phenoxy)-N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]propanamide Openeye Name: 2-(4-chloro-2-methyl-phenoxy)-N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]propanamide CAS Name: 2-(4-chloro-2-methylphenoxy)-N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]propanamide IUPAC Name: 2-(4-chloro-2-methylphenoxy)-N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]propanamide Traditional Name: 2-(4-chloro-2-methyl-phenoxy)-N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]propionamide Formula: C21H24ClNO4 MolecularWeight: 389.87256

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H24ClNO4/c1-13-11-17(22)6-8-18(13)27-15(3)21(24)23-14(2)16-5-7-19-20(12-16)26-10-4-9-25-19/h5-8,11-12,14-15H,4,9-10H2,1-3H3,(H,23,24)