1-[(5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)methyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[(5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)methyl]piperidine-4-carboxylic acid Openeye Name: 1-[(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methyl]piperidine-4-carboxylic acid CAS Name: 1-[(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methyl]piperidine-4-carboxylic acid Traditional Name: 1-[(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methyl]isonipecotic acid Formula: C15H18ClNO4 MolecularWeight: 311.76072

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)O)CC2=CC3=C(C(=C2)Cl)OCCO3

Isomeric SMILES

C1CN(CCC1C(=O)O)CC2=CC3=C(C(=C2)Cl)OCCO3

InChI

InChI=1S/C15H18ClNO4/c16-12-7-10(8-13-14(12)21-6-5-20-13)9-17-3-1-11(2-4-17)15(18)19/h7-8,11H,1-6,9H2,(H,18,19)