2-(2-chloroethylamino)ethyl 4-methylbenzoate hydrochloride

Systemtic Name: 2-(2-chloroethylamino)ethyl 4-methylbenzoate hydrochloride Openeye Name: 2-(2-chloroethylamino)ethyl 4-methylbenzoate hydrochloride CAS Name: 4-methylbenzoic acid 2-(2-chloroethylamino)ethyl ester hydrochloride IUPAC Name: 2-(2-chloroethylamino)ethyl 4-methylbenzoate hydrochloride Traditional Name: 4-methylbenzoic acid 2-(2-chloroethylamino)ethyl ester hydrochloride Formula: C12H17Cl2NO2 MolecularWeight: 278.17488

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)OCCNCCCl.Cl

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)OCCNCCCl.Cl

InChI

InChI=1S/C12H16ClNO2.ClH/c1-10-2-4-11(5-3-10)12(15)16-9-8-14-7-6-13;/h2-5,14H,6-9H2,1H3;1H