ethanedioic acid; 1-(2-naphthalen-1-yloxyethyl)azepane

Systemtic Name: ethanedioic acid; 1-(2-naphthalen-1-yloxyethyl)azepane Openeye Name: 1-[2-(1-naphthyloxy)ethyl]azepane; oxalic acid CAS Name: 1-[2-(1-naphthalenyloxy)ethyl]azepane; oxalic acid IUPAC Name: 1-(2-naphthalen-1-yloxyethyl)azepane; oxalic acid Traditional Name: 1-[2-(1-naphthoxy)ethyl]azepane; oxalic acid Formula: C20H25NO5 MolecularWeight: 359.4162

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)CCOC2=CC=CC3=CC=CC=C32.C(=O)(C(=O)O)O

Isomeric SMILES

C1CCCN(CC1)CCOC2=CC=CC3=CC=CC=C32.C(=O)(C(=O)O)O

InChI

InChI=1S/C18H23NO.C2H2O4/c1-2-6-13-19(12-5-1)14-15-20-18-11-7-9-16-8-3-4-10-17(16)18;3-1(4)2(5)6/h3-4,7-11H,1-2,5-6,12-15H2;(H,3,4)(H,5,6)