2-[(1-butylpiperidin-4-yl)methyl]-1,3-benzodioxole-4-carboxylate

Systemtic Name: 2-[(1-butylpiperidin-4-yl)methyl]-1,3-benzodioxole-4-carboxylate Openeye Name: 2-[(1-butyl-4-piperidyl)methyl]-1,3-benzodioxole-4-carboxylate CAS Name: 2-[(1-butyl-4-piperidinyl)methyl]-1,3-benzodioxole-4-carboxylate IUPAC Name: 2-[(1-butylpiperidin-4-yl)methyl]-1,3-benzodioxole-4-carboxylate Traditional Name: 2-[(1-butyl-4-piperidyl)methyl]-1,3-benzodioxole-4-carboxylate Formula: C18H24NO4- MolecularWeight: 318.38746

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CCC(CC1)CC2OC3=CC=CC(=C3O2)C(=O)[O-]

Isomeric SMILES

CCCCN1CCC(CC1)CC2OC3=CC=CC(=C3O2)C(=O)[O-]

InChI

InChI=1S/C18H25NO4/c1-2-3-9-19-10-7-13(8-11-19)12-16-22-15-6-4-5-14(18(20)21)17(15)23-16/h4-6,13,16H,2-3,7-12H2,1H3,(H,20,21)/p-1