4-[(6-chloranyl-1,3-benzodioxol-5-yl)methyl]-1-(naphthalen-1-ylmethyl)-1,4-diazepan-5-one

Systemtic Name: 4-[(6-chloranyl-1,3-benzodioxol-5-yl)methyl]-1-(naphthalen-1-ylmethyl)-1,4-diazepan-5-one Openeye Name: 4-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-1-(1-naphthylmethyl)-1,4-diazepan-5-one CAS Name: 4-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-1-(1-naphthalenylmethyl)-1,4-diazepan-5-one IUPAC Name: 4-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-1-(naphthalen-1-ylmethyl)-1,4-diazepan-5-one Traditional Name: 4-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-1-(1-naphthylmethyl)-1,4-diazepan-5-one Formula: C24H23ClN2O3 MolecularWeight: 422.90402

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1=O)CC2=CC3=C(C=C2Cl)OCO3)CC4=CC=CC5=CC=CC=C54

Isomeric SMILES

C1CN(CCN(C1=O)CC2=CC3=C(C=C2Cl)OCO3)CC4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C24H23ClN2O3/c25-21-13-23-22(29-16-30-23)12-19(21)15-27-11-10-26(9-8-24(27)28)14-18-6-3-5-17-4-1-2-7-20(17)18/h1-7,12-13H,8-11,14-16H2