ethanedioic acid; ethyl 1-[(2-methyl-1H-indol-3-yl)methyl]piperidine-3-carboxylate

Systemtic Name: ethanedioic acid; ethyl 1-[(2-methyl-1H-indol-3-yl)methyl]piperidine-3-carboxylate Openeye Name: ethyl 1-[(2-methyl-1H-indol-3-yl)methyl]piperidine-3-carboxylate; oxalic acid CAS Name: 1-[(2-methyl-1H-indol-3-yl)methyl]-3-piperidinecarboxylic acid ethyl ester; oxalic acid IUPAC Name: ethyl 1-[(2-methyl-1H-indol-3-yl)methyl]piperidine-3-carboxylate; oxalic acid Traditional Name: 1-[(2-methyl-1H-indol-3-yl)methyl]nipecotic acid ethyl ester; oxalic acid Formula: C20H26N2O6 MolecularWeight: 390.43024

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)CC2=C(NC3=CC=CC=C32)C.C(=O)(C(=O)O)O

Isomeric SMILES

CCOC(=O)C1CCCN(C1)CC2=C(NC3=CC=CC=C32)C.C(=O)(C(=O)O)O

InChI

InChI=1S/C18H24N2O2.C2H2O4/c1-3-22-18(21)14-7-6-10-20(11-14)12-16-13(2)19-17-9-5-4-8-15(16)17;3-1(4)2(5)6/h4-5,8-9,14,19H,3,6-7,10-12H2,1-2H3;(H,3,4)(H,5,6)