methyl 2-methoxy-5-[2-[(phenylmethyl)amino]ethyl]benzoate hydrochloride

Systemtic Name: methyl 2-methoxy-5-[2-[(phenylmethyl)amino]ethyl]benzoate hydrochloride Openeye Name: methyl 5-[2-(benzylamino)ethyl]-2-methoxy-benzoate hydrochloride CAS Name: 2-methoxy-5-[2-[(phenylmethyl)amino]ethyl]benzoic acid methyl ester hydrochloride IUPAC Name: methyl 5-[2-(benzylamino)ethyl]-2-methoxybenzoate hydrochloride Traditional Name: 5-[2-(benzylamino)ethyl]-2-methoxy-benzoic acid methyl ester hydrochloride Formula: C18H22ClNO3 MolecularWeight: 335.82518

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNCC2=CC=CC=C2)C(=O)OC.Cl

Isomeric SMILES

COC1=C(C=C(C=C1)CCNCC2=CC=CC=C2)C(=O)OC.Cl

InChI

InChI=1S/C18H21NO3.ClH/c1-21-17-9-8-14(12-16(17)18(20)22-2)10-11-19-13-15-6-4-3-5-7-15;/h3-9,12,19H,10-11,13H2,1-2H3;1H