ethyl 2-phenoxyethanoate; phenylmethanamine; hydrochloride

Systemtic Name: ethyl 2-phenoxyethanoate; phenylmethanamine; hydrochloride Openeye Name: ethyl 2-phenoxyacetate; phenylmethanamine; hydrochloride CAS Name: 2-phenoxyacetic acid ethyl ester; phenylmethanamine; hydrochloride IUPAC Name: ethyl 2-phenoxyacetate; phenylmethanamine; hydrochloride Traditional Name: benzylamine; 2-phenoxyacetic acid ethyl ester; hydrochloride Formula: C17H22ClNO3 MolecularWeight: 323.81448

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)COC1=CC=CC=C1.C1=CC=C(C=C1)CN.Cl

Isomeric SMILES

CCOC(=O)COC1=CC=CC=C1.C1=CC=C(C=C1)CN.Cl

InChI

InChI=1S/C10H12O3.C7H9N.ClH/c1-2-12-10(11)8-13-9-6-4-3-5-7-9;8-6-7-4-2-1-3-5-7;/h3-7H,2,8H2,1H3;1-5H,6,8H2;1H