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

Systemtic Name: N,N-dimethyl-3-(3-methyl-1-phenyl-3H-2-benzofuran-1-yl)propan-1-amine; ethanedioic acid Openeye Name: N,N-dimethyl-3-(3-methyl-1-phenyl-3H-isobenzofuran-1-yl)propan-1-amine; oxalic acid CAS Name: N,N-dimethyl-3-(3-methyl-1-phenyl-3H-isobenzofuran-1-yl)-1-propanamine; oxalic acid IUPAC Name: N,N-dimethyl-3-(3-methyl-1-phenyl-3H-2-benzofuran-1-yl)propan-1-amine; oxalic acid Traditional Name: dimethyl-[3-(3-methyl-1-phenyl-phthalan-1-yl)propyl]amine; oxalic acid Formula: C22H27NO5 MolecularWeight: 385.45348

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H25NO.C2H2O4/c1-16-18-12-7-8-13-19(18)20(22-16,14-9-15-21(2)3)17-10-5-4-6-11-17;3-1(4)2(5)6/h4-8,10-13,16H,9,14-15H2,1-3H3;(H,3,4)(H,5,6)