4-(diethylaminomethyl)-3-propyl-benzenesulfonate hydrochloride

Systemtic Name: 4-(diethylaminomethyl)-3-propyl-benzenesulfonate hydrochloride Openeye Name: 4-(diethylaminomethyl)-3-propyl-benzenesulfonate hydrochloride CAS Name: 4-(diethylaminomethyl)-3-propylbenzenesulfonate hydrochloride IUPAC Name: 4-(diethylaminomethyl)-3-propylbenzenesulfonate hydrochloride Traditional Name: 4-(diethylaminomethyl)-3-propyl-besylate hydrochloride Formula: C14H23ClNO3S- MolecularWeight: 320.85532

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1)S(=O)(=O)[O-])CN(CC)CC.Cl

Isomeric SMILES

CCCC1=C(C=CC(=C1)S(=O)(=O)[O-])CN(CC)CC.Cl

InChI

InChI=1S/C14H23NO3S.ClH/c1-4-7-12-10-14(19(16,17)18)9-8-13(12)11-15(5-2)6-3;/h8-10H,4-7,11H2,1-3H3,(H,16,17,18);1H/p-1