2-(butan-2-ylamino)ethyl 3,4-bis(chloranyl)benzoate hydrochloride

Systemtic Name: 2-(butan-2-ylamino)ethyl 3,4-bis(chloranyl)benzoate hydrochloride Openeye Name: 2-(sec-butylamino)ethyl 3,4-dichlorobenzoate hydrochloride CAS Name: 3,4-dichlorobenzoic acid 2-(butan-2-ylamino)ethyl ester hydrochloride IUPAC Name: 2-(butan-2-ylamino)ethyl 3,4-dichlorobenzoate hydrochloride Traditional Name: 3,4-dichlorobenzoic acid 2-(sec-butylamino)ethyl ester hydrochloride Formula: C13H18Cl3NO2 MolecularWeight: 326.64652

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NCCOC(=O)C1=CC(=C(C=C1)Cl)Cl.Cl

Isomeric SMILES

CCC(C)NCCOC(=O)C1=CC(=C(C=C1)Cl)Cl.Cl

InChI

InChI=1S/C13H17Cl2NO2.ClH/c1-3-9(2)16-6-7-18-13(17)10-4-5-11(14)12(15)8-10;/h4-5,8-9,16H,3,6-7H2,1-2H3;1H