ethanedioic acid; N-methyl-3-(3-methyl-1-phenyl-3H-2-benzofuran-1-yl)propan-1-amine

Systemtic Name: ethanedioic acid; N-methyl-3-(3-methyl-1-phenyl-3H-2-benzofuran-1-yl)propan-1-amine Openeye Name: N-methyl-3-(3-methyl-1-phenyl-3H-isobenzofuran-1-yl)propan-1-amine; oxalic acid CAS Name: N-methyl-3-(3-methyl-1-phenyl-3H-isobenzofuran-1-yl)-1-propanamine; oxalic acid IUPAC Name: N-methyl-3-(3-methyl-1-phenyl-3H-2-benzofuran-1-yl)propan-1-amine; oxalic acid Traditional Name: methyl-[3-(3-methyl-1-phenyl-phthalan-1-yl)propyl]amine; oxalic acid Formula: C21H25NO5 MolecularWeight: 371.4269

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2=CC=CC=C2C(O1)(CCCNC)C3=CC=CC=C3.C(=O)(C(=O)O)O

Isomeric SMILES

CC1C2=CC=CC=C2C(O1)(CCCNC)C3=CC=CC=C3.C(=O)(C(=O)O)O

InChI

InChI=1S/C19H23NO.C2H2O4/c1-15-17-11-6-7-12-18(17)19(21-15,13-8-14-20-2)16-9-4-3-5-10-16;3-1(4)2(5)6/h3-7,9-12,15,20H,8,13-14H2,1-2H3;(H,3,4)(H,5,6)