ethanedioic acid; 2-[(naphthalen-1-ylmethylamino)methyl]-3,4-dihydro-2H-chromen-7-ol

Systemtic Name: ethanedioic acid; 2-[(naphthalen-1-ylmethylamino)methyl]-3,4-dihydro-2H-chromen-7-ol Openeye Name: 2-[(1-naphthylmethylamino)methyl]chroman-7-ol; oxalic acid CAS Name: 2-[(1-naphthalenylmethylamino)methyl]-3,4-dihydro-2H-1-benzopyran-7-ol; oxalic acid IUPAC Name: 2-[(naphthalen-1-ylmethylamino)methyl]-3,4-dihydro-2H-chromen-7-ol; oxalic acid Traditional Name: 2-[(1-naphthylmethylamino)methyl]chroman-7-ol; oxalic acid Formula: C23H23NO6 MolecularWeight: 409.43182

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=C(C=C2)O)OC1CNCC3=CC=CC4=CC=CC=C43.C(=O)(C(=O)O)O

Isomeric SMILES

C1CC2=C(C=C(C=C2)O)OC1CNCC3=CC=CC4=CC=CC=C43.C(=O)(C(=O)O)O

InChI

InChI=1S/C21H21NO2.C2H2O4/c23-18-10-8-16-9-11-19(24-21(16)12-18)14-22-13-17-6-3-5-15-4-1-2-7-20(15)17;3-1(4)2(5)6/h1-8,10,12,19,22-23H,9,11,13-14H2;(H,3,4)(H,5,6)