N-methyl-3-(3-propan-2-ylthiophen-2-yl)-3-(6-propylnaphthalen-1-yl)oxy-propan-1-amine; 2-oxidanylpropane-1,2,3-tricarboxylic acid

Systemtic Name: N-methyl-3-(3-propan-2-ylthiophen-2-yl)-3-(6-propylnaphthalen-1-yl)oxy-propan-1-amine; 2-oxidanylpropane-1,2,3-tricarboxylic acid Openeye Name: citric acid; 3-(3-isopropyl-2-thienyl)-N-methyl-3-[(6-propyl-1-naphthyl)oxy]propan-1-amine CAS Name: 2-hydroxypropane-1,2,3-tricarboxylic acid; N-methyl-3-(3-propan-2-yl-2-thiophenyl)-3-[(6-propyl-1-naphthalenyl)oxy]-1-propanamine IUPAC Name: 2-hydroxypropane-1,2,3-tricarboxylic acid; N-methyl-3-(3-propan-2-ylthiophen-2-yl)-3-(6-propylnaphthalen-1-yl)oxypropan-1-amine Traditional Name: citric acid; [3-(3-isopropyl-2-thienyl)-3-(6-propyl-1-naphthoxy)propyl]-methyl-amine Formula: C30H39NO8S MolecularWeight: 573.69756

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC2=C(C=C1)C(=CC=C2)OC(CCNC)C3=C(C=CS3)C(C)C.C(C(=O)O)C(CC(=O)O)(C(=O)O)O

Isomeric SMILES

CCCC1=CC2=C(C=C1)C(=CC=C2)OC(CCNC)C3=C(C=CS3)C(C)C.C(C(=O)O)C(CC(=O)O)(C(=O)O)O

InChI

InChI=1S/C24H31NOS.C6H8O7/c1-5-7-18-10-11-21-19(16-18)8-6-9-22(21)26-23(12-14-25-4)24-20(17(2)3)13-15-27-24;7-3(8)1-6(13,5(11)12)2-4(9)10/h6,8-11,13,15-17,23,25H,5,7,12,14H2,1-4H3;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)