ethanedioic acid; 2-[[methyl-(phenylmethyl)amino]methyl]-3,4-dihydro-2H-chromen-7-ol

Systemtic Name: ethanedioic acid; 2-[[methyl-(phenylmethyl)amino]methyl]-3,4-dihydro-2H-chromen-7-ol Openeye Name: 2-[[benzyl(methyl)amino]methyl]chroman-7-ol; oxalic acid CAS Name: 2-[[methyl-(phenylmethyl)amino]methyl]-3,4-dihydro-2H-1-benzopyran-7-ol; oxalic acid IUPAC Name: 2-[[benzyl(methyl)amino]methyl]-3,4-dihydro-2H-chromen-7-ol; oxalic acid Traditional Name: 2-[[benzyl(methyl)amino]methyl]chroman-7-ol; oxalic acid Formula: C20H23NO6 MolecularWeight: 373.39972

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1CCC2=C(O1)C=C(C=C2)O)CC3=CC=CC=C3.C(=O)(C(=O)O)O

Isomeric SMILES

CN(CC1CCC2=C(O1)C=C(C=C2)O)CC3=CC=CC=C3.C(=O)(C(=O)O)O

InChI

InChI=1S/C18H21NO2.C2H2O4/c1-19(12-14-5-3-2-4-6-14)13-17-10-8-15-7-9-16(20)11-18(15)21-17;3-1(4)2(5)6/h2-7,9,11,17,20H,8,10,12-13H2,1H3;(H,3,4)(H,5,6)