2-[(5-chloranyl-2-methoxy-phenyl)methyl-methyl-amino]-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethanamide

Systemtic Name: 2-[(5-chloranyl-2-methoxy-phenyl)methyl-methyl-amino]-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethanamide Openeye Name: 2-[(5-chloro-2-methoxy-phenyl)methyl-methyl-amino]-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)acetamide CAS Name: 2-[(5-chloro-2-methoxyphenyl)methyl-methylamino]-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)acetamide IUPAC Name: 2-[(5-chloro-2-methoxyphenyl)methyl-methylamino]-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)acetamide Traditional Name: 2-[(5-chloro-2-methoxy-benzyl)-methyl-amino]-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)acetamide Formula: C20H23ClN2O4 MolecularWeight: 390.86062

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=C(C=CC(=C1)Cl)OC)CC(=O)NC2=CC3=C(C=C2)OCCCO3

Isomeric SMILES

CN(CC1=C(C=CC(=C1)Cl)OC)CC(=O)NC2=CC3=C(C=C2)OCCCO3

InChI

InChI=1S/C20H23ClN2O4/c1-23(12-14-10-15(21)4-6-17(14)25-2)13-20(24)22-16-5-7-18-19(11-16)27-9-3-8-26-18/h4-7,10-11H,3,8-9,12-13H2,1-2H3,(H,22,24)