1-[(6-chloranyl-1,3-benzodioxol-5-yl)methyl]-4-(phenylmethyl)-1,4-diazepane

Systemtic Name: 1-[(6-chloranyl-1,3-benzodioxol-5-yl)methyl]-4-(phenylmethyl)-1,4-diazepane Openeye Name: 1-benzyl-4-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-1,4-diazepane CAS Name: 1-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-4-(phenylmethyl)-1,4-diazepane IUPAC Name: 1-benzyl-4-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-1,4-diazepane Traditional Name: 1-benzyl-4-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-1,4-diazepane Formula: C20H23ClN2O2 MolecularWeight: 358.86182

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)CC2=CC3=C(C=C2Cl)OCO3)CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN(C1)CC2=CC3=C(C=C2Cl)OCO3)CC4=CC=CC=C4

InChI

InChI=1S/C20H23ClN2O2/c21-18-12-20-19(24-15-25-20)11-17(18)14-23-8-4-7-22(9-10-23)13-16-5-2-1-3-6-16/h1-3,5-6,11-12H,4,7-10,13-15H2