ethanedioic acid; 2-[(2-ethoxyphenyl)methyl]-3,4-dihydro-1H-isoquinoline

Systemtic Name: ethanedioic acid; 2-[(2-ethoxyphenyl)methyl]-3,4-dihydro-1H-isoquinoline Openeye Name: 2-[(2-ethoxyphenyl)methyl]-3,4-dihydro-1H-isoquinoline; oxalic acid CAS Name: 2-[(2-ethoxyphenyl)methyl]-3,4-dihydro-1H-isoquinoline; oxalic acid IUPAC Name: 2-[(2-ethoxyphenyl)methyl]-3,4-dihydro-1H-isoquinoline; oxalic acid Traditional Name: 2-(2-ethoxybenzyl)-3,4-dihydro-1H-isoquinoline; oxalic acid Formula: C20H23NO5 MolecularWeight: 357.40032

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1CN2CCC3=CC=CC=C3C2.C(=O)(C(=O)O)O

Isomeric SMILES

CCOC1=CC=CC=C1CN2CCC3=CC=CC=C3C2.C(=O)(C(=O)O)O

InChI

InChI=1S/C18H21NO.C2H2O4/c1-2-20-18-10-6-5-9-17(18)14-19-12-11-15-7-3-4-8-16(15)13-19;3-1(4)2(5)6/h3-10H,2,11-14H2,1H3;(H,3,4)(H,5,6)