2-(2-chloroethylamino)ethyl 4-methylbenzoate

Systemtic Name: 2-(2-chloroethylamino)ethyl 4-methylbenzoate Openeye Name: 2-(2-chloroethylamino)ethyl 4-methylbenzoate CAS Name: 4-methylbenzoic acid 2-(2-chloroethylamino)ethyl ester IUPAC Name: 2-(2-chloroethylamino)ethyl 4-methylbenzoate Traditional Name: 4-methylbenzoic acid 2-(2-chloroethylamino)ethyl ester Formula: C12H16ClNO2 MolecularWeight: 241.71394

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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