6-chloranyl-3-[1-(2,3-dihydro-1H-inden-2-ylmethyl)piperidin-4-yl]-1H-indole; ethanedioic acid

Systemtic Name: 6-chloranyl-3-[1-(2,3-dihydro-1H-inden-2-ylmethyl)piperidin-4-yl]-1H-indole; ethanedioic acid Openeye Name: 6-chloro-3-[1-(indan-2-ylmethyl)-4-piperidyl]-1H-indole; oxalic acid CAS Name: 6-chloro-3-[1-(2,3-dihydro-1H-inden-2-ylmethyl)-4-piperidinyl]-1H-indole; oxalic acid IUPAC Name: 6-chloro-3-[1-(2,3-dihydro-1H-inden-2-ylmethyl)piperidin-4-yl]-1H-indole; oxalic acid Traditional Name: 6-chloro-3-[1-(indan-2-ylmethyl)-4-piperidyl]-1H-indole; oxalic acid Formula: C25H27ClN2O4 MolecularWeight: 454.94588

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=CNC3=C2C=CC(=C3)Cl)CC4CC5=CC=CC=C5C4.C(=O)(C(=O)O)O

Isomeric SMILES

C1CN(CCC1C2=CNC3=C2C=CC(=C3)Cl)CC4CC5=CC=CC=C5C4.C(=O)(C(=O)O)O

InChI

InChI=1S/C23H25ClN2.C2H2O4/c24-20-5-6-21-22(14-25-23(21)13-20)17-7-9-26(10-8-17)15-16-11-18-3-1-2-4-19(18)12-16;3-1(4)2(5)6/h1-6,13-14,16-17,25H,7-12,15H2;(H,3,4)(H,5,6)