4-(1,3-benzodioxol-5-yl)-2-(diethylamino)-2-methyl-butanoic acid

Systemtic Name: 4-(1,3-benzodioxol-5-yl)-2-(diethylamino)-2-methyl-butanoic acid Openeye Name: 4-(1,3-benzodioxol-5-yl)-2-(diethylamino)-2-methyl-butanoic acid CAS Name: 4-(1,3-benzodioxol-5-yl)-2-(diethylamino)-2-methylbutanoic acid IUPAC Name: 4-(1,3-benzodioxol-5-yl)-2-(diethylamino)-2-methylbutanoic acid Traditional Name: 4-(1,3-benzodioxol-5-yl)-2-(diethylamino)-2-methyl-butyric acid Formula: C16H23NO4 MolecularWeight: 293.35812

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(C)(CCC1=CC2=C(C=C1)OCO2)C(=O)O

Isomeric SMILES

CCN(CC)C(C)(CCC1=CC2=C(C=C1)OCO2)C(=O)O

InChI

InChI=1S/C16H23NO4/c1-4-17(5-2)16(3,15(18)19)9-8-12-6-7-13-14(10-12)21-11-20-13/h6-7,10H,4-5,8-9,11H2,1-3H3,(H,18,19)