2-[6-(diethylaminomethyl)-1,3-benzodioxol-5-yl]butanoate hydrochloride

Systemtic Name: 2-[6-(diethylaminomethyl)-1,3-benzodioxol-5-yl]butanoate hydrochloride Openeye Name: 2-[6-(diethylaminomethyl)-1,3-benzodioxol-5-yl]butanoate hydrochloride CAS Name: 2-[6-(diethylaminomethyl)-1,3-benzodioxol-5-yl]butanoate hydrochloride IUPAC Name: 2-[6-(diethylaminomethyl)-1,3-benzodioxol-5-yl]butanoate hydrochloride Traditional Name: 2-[6-(diethylaminomethyl)-1,3-benzodioxol-5-yl]butyrate hydrochloride Formula: C16H23ClNO4- MolecularWeight: 328.81112

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC2=C(C=C1CN(CC)CC)OCO2)C(=O)[O-].Cl

Isomeric SMILES

CCC(C1=CC2=C(C=C1CN(CC)CC)OCO2)C(=O)[O-].Cl

InChI

InChI=1S/C16H23NO4.ClH/c1-4-12(16(18)19)13-8-15-14(20-10-21-15)7-11(13)9-17(5-2)6-3;/h7-8,12H,4-6,9-10H2,1-3H3,(H,18,19);1H/p-1