N,N-dimethyl-4,4-bis(3-methyl-1-benzofuran-2-yl)-1-phenyl-cyclohexan-1-amine; 2-oxidanylpropane-1,2,3-tricarboxylic acid

Systemtic Name: N,N-dimethyl-4,4-bis(3-methyl-1-benzofuran-2-yl)-1-phenyl-cyclohexan-1-amine; 2-oxidanylpropane-1,2,3-tricarboxylic acid Openeye Name: citric acid; N,N-dimethyl-4,4-bis(3-methylbenzofuran-2-yl)-1-phenyl-cyclohexanamine CAS Name: N,N-dimethyl-4,4-bis(3-methyl-2-benzofuranyl)-1-phenyl-1-cyclohexanamine; 2-hydroxypropane-1,2,3-tricarboxylic acid IUPAC Name: N,N-dimethyl-4,4-bis(3-methyl-1-benzofuran-2-yl)-1-phenylcyclohexan-1-amine; 2-hydroxypropane-1,2,3-tricarboxylic acid Traditional Name: [4,4-bis(3-methylbenzofuran-2-yl)-1-phenyl-cyclohexyl]-dimethyl-amine; citric acid Formula: C38H41NO9 MolecularWeight: 655.73344

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=CC=CC=C12)C3(CCC(CC3)(C4=CC=CC=C4)N(C)C)C5=C(C6=CC=CC=C6O5)C.C(C(=O)O)C(CC(=O)O)(C(=O)O)O

Isomeric SMILES

CC1=C(OC2=CC=CC=C12)C3(CCC(CC3)(C4=CC=CC=C4)N(C)C)C5=C(C6=CC=CC=C6O5)C.C(C(=O)O)C(CC(=O)O)(C(=O)O)O

InChI

InChI=1S/C32H33NO2.C6H8O7/c1-22-25-14-8-10-16-27(25)34-29(22)31(30-23(2)26-15-9-11-17-28(26)35-30)18-20-32(21-19-31,33(3)4)24-12-6-5-7-13-24;7-3(8)1-6(13,5(11)12)2-4(9)10/h5-17H,18-21H2,1-4H3;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)