2-[4-[(7-chloranyl-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl]ethanoic acid

Systemtic Name: 2-[4-[(7-chloranyl-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl]ethanoic acid Openeye Name: 2-[4-[(7-chloro-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl]acetic acid CAS Name: 2-[4-[(7-chloro-1,3-benzodioxol-5-yl)methyl]-1-piperazinyl]acetic acid IUPAC Name: 2-[4-[(7-chloro-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl]acetic acid Traditional Name: 2-[4-[(7-chloro-1,3-benzodioxol-5-yl)methyl]piperazino]acetic acid Formula: C14H17ClN2O4 MolecularWeight: 312.74878

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC3=C(C(=C2)Cl)OCO3)CC(=O)O

Isomeric SMILES

C1CN(CCN1CC2=CC3=C(C(=C2)Cl)OCO3)CC(=O)O

InChI

InChI=1S/C14H17ClN2O4/c15-11-5-10(6-12-14(11)21-9-20-12)7-16-1-3-17(4-2-16)8-13(18)19/h5-6H,1-4,7-9H2,(H,18,19)