2-[4-(azetidin-1-yl)-4-phenyl-cyclohexyl]-3-methyl-1H-indole; 2-oxidanylpropane-1,2,3-tricarboxylic acid

Systemtic Name: 2-[4-(azetidin-1-yl)-4-phenyl-cyclohexyl]-3-methyl-1H-indole; 2-oxidanylpropane-1,2,3-tricarboxylic acid Openeye Name: 2-[4-(azetidin-1-yl)-4-phenyl-cyclohexyl]-3-methyl-1H-indole; citric acid CAS Name: 2-[4-(1-azetidinyl)-4-phenylcyclohexyl]-3-methyl-1H-indole; 2-hydroxypropane-1,2,3-tricarboxylic acid IUPAC Name: 2-[4-(azetidin-1-yl)-4-phenylcyclohexyl]-3-methyl-1H-indole; 2-hydroxypropane-1,2,3-tricarboxylic acid Traditional Name: 2-[4-(azetidin-1-yl)-4-phenyl-cyclohexyl]-3-methyl-1H-indole; citric acid Formula: C30H36N2O7 MolecularWeight: 536.61604

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC2=CC=CC=C12)C3CCC(CC3)(C4=CC=CC=C4)N5CCC5.C(C(=O)O)C(CC(=O)O)(C(=O)O)O

Isomeric SMILES

CC1=C(NC2=CC=CC=C12)C3CCC(CC3)(C4=CC=CC=C4)N5CCC5.C(C(=O)O)C(CC(=O)O)(C(=O)O)O

InChI

InChI=1S/C24H28N2.C6H8O7/c1-18-21-10-5-6-11-22(21)25-23(18)19-12-14-24(15-13-19,26-16-7-17-26)20-8-3-2-4-9-20;7-3(8)1-6(13,5(11)12)2-4(9)10/h2-6,8-11,19,25H,7,12-17H2,1H3;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)