ethanedioic acid; 4-[1-(phenylmethyl)-3,6-dihydro-2H-pyridin-5-yl]-1H-indole

Systemtic Name: ethanedioic acid; 4-[1-(phenylmethyl)-3,6-dihydro-2H-pyridin-5-yl]-1H-indole Openeye Name: 4-(1-benzyl-3,6-dihydro-2H-pyridin-5-yl)-1H-indole; oxalic acid CAS Name: oxalic acid; 4-[1-(phenylmethyl)-3,6-dihydro-2H-pyridin-5-yl]-1H-indole IUPAC Name: 4-(1-benzyl-3,6-dihydro-2H-pyridin-5-yl)-1H-indole; oxalic acid Traditional Name: 4-(1-benzyl-3,6-dihydro-2H-pyridin-5-yl)-1H-indole; oxalic acid Formula: C22H22N2O4 MolecularWeight: 378.42108

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(=C1)C2=C3C=CNC3=CC=C2)CC4=CC=CC=C4.C(=O)(C(=O)O)O

Isomeric SMILES

C1CN(CC(=C1)C2=C3C=CNC3=CC=C2)CC4=CC=CC=C4.C(=O)(C(=O)O)O

InChI

InChI=1S/C20H20N2.C2H2O4/c1-2-6-16(7-3-1)14-22-13-5-8-17(15-22)18-9-4-10-20-19(18)11-12-21-20;3-1(4)2(5)6/h1-4,6-12,21H,5,13-15H2;(H,3,4)(H,5,6)