3-cyclohexyl-N-methyl-3-naphthalen-2-yloxy-propan-1-amine; 2-oxidanylpropane-1,2,3-tricarboxylic acid

Systemtic Name: 3-cyclohexyl-N-methyl-3-naphthalen-2-yloxy-propan-1-amine; 2-oxidanylpropane-1,2,3-tricarboxylic acid Openeye Name: citric acid; 3-cyclohexyl-N-methyl-3-(2-naphthyloxy)propan-1-amine CAS Name: 3-cyclohexyl-N-methyl-3-(2-naphthalenyloxy)-1-propanamine; 2-hydroxypropane-1,2,3-tricarboxylic acid IUPAC Name: 3-cyclohexyl-N-methyl-3-naphthalen-2-yloxypropan-1-amine; 2-hydroxypropane-1,2,3-tricarboxylic acid Traditional Name: citric acid; [3-cyclohexyl-3-(2-naphthoxy)propyl]-methyl-amine Formula: C26H35NO8 MolecularWeight: 489.558

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Descriptors Computed from Structure

Canonical SMILES:

CNCCC(C1CCCCC1)OC2=CC3=CC=CC=C3C=C2.C(C(=O)O)C(CC(=O)O)(C(=O)O)O

Isomeric SMILES

CNCCC(C1CCCCC1)OC2=CC3=CC=CC=C3C=C2.C(C(=O)O)C(CC(=O)O)(C(=O)O)O

InChI

InChI=1S/C20H27NO.C6H8O7/c1-21-14-13-20(17-8-3-2-4-9-17)22-19-12-11-16-7-5-6-10-18(16)15-19;7-3(8)1-6(13,5(11)12)2-4(9)10/h5-7,10-12,15,17,20-21H,2-4,8-9,13-14H2,1H3;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)