ethanedioic acid; 1-methyl-3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-5-phenylmethoxy-indole

Systemtic Name: ethanedioic acid; 1-methyl-3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-5-phenylmethoxy-indole Openeye Name: 5-benzyloxy-1-methyl-3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)indole; oxalic acid CAS Name: 1-methyl-3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-5-phenylmethoxyindole; oxalic acid IUPAC Name: 1-methyl-3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-5-phenylmethoxyindole; oxalic acid Traditional Name: 5-benzoxy-1-methyl-3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)indole; oxalic acid Formula: C24H26N2O5 MolecularWeight: 422.47364

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(=CC1)C2=CN(C3=C2C=C(C=C3)OCC4=CC=CC=C4)C.C(=O)(C(=O)O)O

Isomeric SMILES

CN1CCC(=CC1)C2=CN(C3=C2C=C(C=C3)OCC4=CC=CC=C4)C.C(=O)(C(=O)O)O

InChI

InChI=1S/C22H24N2O.C2H2O4/c1-23-12-10-18(11-13-23)21-15-24(2)22-9-8-19(14-20(21)22)25-16-17-6-4-3-5-7-17;3-1(4)2(5)6/h3-10,14-15H,11-13,16H2,1-2H3;(H,3,4)(H,5,6)