1-[4-(2-chloranylphenoxy)butyl]azepane; ethanedioic acid

Systemtic Name: 1-[4-(2-chloranylphenoxy)butyl]azepane; ethanedioic acid Openeye Name: 1-[4-(2-chlorophenoxy)butyl]azepane; oxalic acid CAS Name: 1-[4-(2-chlorophenoxy)butyl]azepane; oxalic acid IUPAC Name: 1-[4-(2-chlorophenoxy)butyl]azepane; oxalic acid Traditional Name: 1-[4-(2-chlorophenoxy)butyl]azepane; oxalic acid Formula: C18H26ClNO5 MolecularWeight: 371.85574

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)CCCCOC2=CC=CC=C2Cl.C(=O)(C(=O)O)O

Isomeric SMILES

C1CCCN(CC1)CCCCOC2=CC=CC=C2Cl.C(=O)(C(=O)O)O

InChI

InChI=1S/C16H24ClNO.C2H2O4/c17-15-9-3-4-10-16(15)19-14-8-7-13-18-11-5-1-2-6-12-18;3-1(4)2(5)6/h3-4,9-10H,1-2,5-8,11-14H2;(H,3,4)(H,5,6)