3-[3-(3,4-dihydro-2H-chromen-2-ylmethylamino)propoxy]aniline; ethanedioic acid

Systemtic Name: 3-[3-(3,4-dihydro-2H-chromen-2-ylmethylamino)propoxy]aniline; ethanedioic acid Openeye Name: 3-[3-(chroman-2-ylmethylamino)propoxy]aniline; oxalic acid CAS Name: 3-[3-(3,4-dihydro-2H-1-benzopyran-2-ylmethylamino)propoxy]aniline; oxalic acid IUPAC Name: 3-[3-(3,4-dihydro-2H-chromen-2-ylmethylamino)propoxy]aniline; oxalic acid Traditional Name: 3-(3-aminophenoxy)propyl-(chroman-2-ylmethyl)amine; oxalic acid Formula: C21H26N2O6 MolecularWeight: 402.44094

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC=CC=C2OC1CNCCCOC3=CC=CC(=C3)N.C(=O)(C(=O)O)O

Isomeric SMILES

C1CC2=CC=CC=C2OC1CNCCCOC3=CC=CC(=C3)N.C(=O)(C(=O)O)O

InChI

InChI=1S/C19H24N2O2.C2H2O4/c20-16-6-3-7-17(13-16)22-12-4-11-21-14-18-10-9-15-5-1-2-8-19(15)23-18;3-1(4)2(5)6/h1-3,5-8,13,18,21H,4,9-12,14,20H2;(H,3,4)(H,5,6)