2-(diethylamino)-2-(2-methyl-1,3-benzodioxol-2-yl)butanoate

Systemtic Name: 2-(diethylamino)-2-(2-methyl-1,3-benzodioxol-2-yl)butanoate Openeye Name: 2-(diethylamino)-2-(2-methyl-1,3-benzodioxol-2-yl)butanoate CAS Name: 2-(diethylamino)-2-(2-methyl-1,3-benzodioxol-2-yl)butanoate IUPAC Name: 2-(diethylamino)-2-(2-methyl-1,3-benzodioxol-2-yl)butanoate Traditional Name: 2-(diethylamino)-2-(2-methyl-1,3-benzodioxol-2-yl)butyrate Formula: C16H22NO4- MolecularWeight: 292.35018

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)[O-])(C1(OC2=CC=CC=C2O1)C)N(CC)CC

Isomeric SMILES

CCC(C(=O)[O-])(C1(OC2=CC=CC=C2O1)C)N(CC)CC

InChI

InChI=1S/C16H23NO4/c1-5-16(14(18)19,17(6-2)7-3)15(4)20-12-10-8-9-11-13(12)21-15/h8-11H,5-7H2,1-4H3,(H,18,19)/p-1