ethanedioic acid; 1-[2-(4-piperidin-1-ylbutoxy)phenyl]ethanone

Systemtic Name: ethanedioic acid; 1-[2-(4-piperidin-1-ylbutoxy)phenyl]ethanone Openeye Name: oxalic acid; 1-[2-[4-(1-piperidyl)butoxy]phenyl]ethanone CAS Name: oxalic acid; 1-[2-[4-(1-piperidinyl)butoxy]phenyl]ethanone IUPAC Name: oxalic acid; 1-[2-(4-piperidin-1-ylbutoxy)phenyl]ethanone Traditional Name: oxalic acid; 1-[2-(4-piperidinobutoxy)phenyl]ethanone Formula: C19H27NO6 MolecularWeight: 365.42078

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=CC=C1OCCCCN2CCCCC2.C(=O)(C(=O)O)O

Isomeric SMILES

CC(=O)C1=CC=CC=C1OCCCCN2CCCCC2.C(=O)(C(=O)O)O

InChI

InChI=1S/C17H25NO2.C2H2O4/c1-15(19)16-9-3-4-10-17(16)20-14-8-7-13-18-11-5-2-6-12-18;3-1(4)2(5)6/h3-4,9-10H,2,5-8,11-14H2,1H3;(H,3,4)(H,5,6)