1-[2-(1-bromanylnaphthalen-2-yl)oxyethyl]azepane; ethanedioic acid

Systemtic Name: 1-[2-(1-bromanylnaphthalen-2-yl)oxyethyl]azepane; ethanedioic acid Openeye Name: 1-[2-[(1-bromo-2-naphthyl)oxy]ethyl]azepane; oxalic acid CAS Name: 1-[2-[(1-bromo-2-naphthalenyl)oxy]ethyl]azepane; oxalic acid IUPAC Name: 1-[2-(1-bromonaphthalen-2-yl)oxyethyl]azepane; oxalic acid Traditional Name: 1-[2-(1-bromo-2-naphthoxy)ethyl]azepane; oxalic acid Formula: C20H24BrNO5 MolecularWeight: 438.31226

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)CCOC2=C(C3=CC=CC=C3C=C2)Br.C(=O)(C(=O)O)O

Isomeric SMILES

C1CCCN(CC1)CCOC2=C(C3=CC=CC=C3C=C2)Br.C(=O)(C(=O)O)O

InChI

InChI=1S/C18H22BrNO.C2H2O4/c19-18-16-8-4-3-7-15(16)9-10-17(18)21-14-13-20-11-5-1-2-6-12-20;3-1(4)2(5)6/h3-4,7-10H,1-2,5-6,11-14H2;(H,3,4)(H,5,6)