ethyl benzoate; N-ethyl-2-(2-phenylmethoxyphenyl)ethanamine

Systemtic Name: ethyl benzoate; N-ethyl-2-(2-phenylmethoxyphenyl)ethanamine Openeye Name: 2-(2-benzyloxyphenyl)-N-ethyl-ethanamine; ethyl benzoate CAS Name: benzoic acid ethyl ester; N-ethyl-2-(2-phenylmethoxyphenyl)ethanamine IUPAC Name: ethyl benzoate; N-ethyl-2-(2-phenylmethoxyphenyl)ethanamine Traditional Name: benzoic acid ethyl ester; 2-(2-benzoxyphenyl)ethyl-ethyl-amine Formula: C26H31NO3 MolecularWeight: 405.52924

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Descriptors Computed from Structure

Canonical SMILES:

CCNCCC1=CC=CC=C1OCC2=CC=CC=C2.CCOC(=O)C1=CC=CC=C1

Isomeric SMILES

CCNCCC1=CC=CC=C1OCC2=CC=CC=C2.CCOC(=O)C1=CC=CC=C1

InChI

InChI=1S/C17H21NO.C9H10O2/c1-2-18-13-12-16-10-6-7-11-17(16)19-14-15-8-4-3-5-9-15;1-2-11-9(10)8-6-4-3-5-7-8/h3-11,18H,2,12-14H2,1H3;3-7H,2H2,1H3