1-[(7-chloranyl-1,3-benzodioxol-5-yl)methyl]-1,4-diazepane

Systemtic Name: 1-[(7-chloranyl-1,3-benzodioxol-5-yl)methyl]-1,4-diazepane Openeye Name: 1-[(7-chloro-1,3-benzodioxol-5-yl)methyl]-1,4-diazepane CAS Name: 1-[(7-chloro-1,3-benzodioxol-5-yl)methyl]-1,4-diazepane IUPAC Name: 1-[(7-chloro-1,3-benzodioxol-5-yl)methyl]-1,4-diazepane Traditional Name: 1-[(7-chloro-1,3-benzodioxol-5-yl)methyl]-1,4-diazepane Formula: C13H17ClN2O2 MolecularWeight: 268.73928

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCN(C1)CC2=CC3=C(C(=C2)Cl)OCO3

Isomeric SMILES

C1CNCCN(C1)CC2=CC3=C(C(=C2)Cl)OCO3

InChI

InChI=1S/C13H17ClN2O2/c14-11-6-10(7-12-13(11)18-9-17-12)8-16-4-1-2-15-3-5-16/h6-7,15H,1-5,8-9H2