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

Systemtic Name: 3-(3,3-dimethyl-1H-2-benzofuran-1-yl)-N,N-dimethyl-propan-1-amine; ethanedioic acid Openeye Name: 3-(3,3-dimethyl-1H-isobenzofuran-1-yl)-N,N-dimethyl-propan-1-amine; oxalic acid CAS Name: 3-(3,3-dimethyl-1H-isobenzofuran-1-yl)-N,N-dimethyl-1-propanamine; oxalic acid IUPAC Name: 3-(3,3-dimethyl-1H-2-benzofuran-1-yl)-N,N-dimethylpropan-1-amine; oxalic acid Traditional Name: 3-(3,3-dimethylphthalan-1-yl)propyl-dimethyl-amine; oxalic acid Formula: C17H25NO5 MolecularWeight: 323.3841

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=CC=CC=C2C(O1)CCCN(C)C)C.C(=O)(C(=O)O)O

Isomeric SMILES

CC1(C2=CC=CC=C2C(O1)CCCN(C)C)C.C(=O)(C(=O)O)O

InChI

InChI=1S/C15H23NO.C2H2O4/c1-15(2)13-9-6-5-8-12(13)14(17-15)10-7-11-16(3)4;3-1(4)2(5)6/h5-6,8-9,14H,7,10-11H2,1-4H3;(H,3,4)(H,5,6)