ethanedioic acid; [1-[(2-ethoxyphenyl)methyl]piperidin-4-yl]-pyrrolidin-1-yl-methanone

Systemtic Name: ethanedioic acid; [1-[(2-ethoxyphenyl)methyl]piperidin-4-yl]-pyrrolidin-1-yl-methanone Openeye Name: [1-[(2-ethoxyphenyl)methyl]-4-piperidyl]-pyrrolidin-1-yl-methanone; oxalic acid CAS Name: [1-[(2-ethoxyphenyl)methyl]-4-piperidinyl]-(1-pyrrolidinyl)methanone; oxalic acid IUPAC Name: [1-[(2-ethoxyphenyl)methyl]piperidin-4-yl]-pyrrolidin-1-ylmethanone; oxalic acid Traditional Name: [1-(2-ethoxybenzyl)-4-piperidyl]-pyrrolidino-methanone; oxalic acid Formula: C21H30N2O6 MolecularWeight: 406.4727

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1CN2CCC(CC2)C(=O)N3CCCC3.C(=O)(C(=O)O)O

Isomeric SMILES

CCOC1=CC=CC=C1CN2CCC(CC2)C(=O)N3CCCC3.C(=O)(C(=O)O)O

InChI

InChI=1S/C19H28N2O2.C2H2O4/c1-2-23-18-8-4-3-7-17(18)15-20-13-9-16(10-14-20)19(22)21-11-5-6-12-21;3-1(4)2(5)6/h3-4,7-8,16H,2,5-6,9-15H2,1H3;(H,3,4)(H,5,6)