N-[3-(2-bromanyl-6-chloranyl-4-methyl-phenoxy)propyl]-3-methoxy-propan-1-amine; ethanedioic acid

Systemtic Name: N-[3-(2-bromanyl-6-chloranyl-4-methyl-phenoxy)propyl]-3-methoxy-propan-1-amine; ethanedioic acid Openeye Name: N-[3-(2-bromo-6-chloro-4-methyl-phenoxy)propyl]-3-methoxy-propan-1-amine; oxalic acid CAS Name: N-[3-(2-bromo-6-chloro-4-methylphenoxy)propyl]-3-methoxy-1-propanamine; oxalic acid IUPAC Name: N-[3-(2-bromo-6-chloro-4-methylphenoxy)propyl]-3-methoxypropan-1-amine; oxalic acid Traditional Name: 3-(2-bromo-6-chloro-4-methyl-phenoxy)propyl-(3-methoxypropyl)amine; oxalic acid Formula: C16H23BrClNO6 MolecularWeight: 440.71392

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)Br)OCCCNCCCOC)Cl.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=CC(=C(C(=C1)Br)OCCCNCCCOC)Cl.C(=O)(C(=O)O)O

InChI

InChI=1S/C14H21BrClNO2.C2H2O4/c1-11-9-12(15)14(13(16)10-11)19-8-4-6-17-5-3-7-18-2;3-1(4)2(5)6/h9-10,17H,3-8H2,1-2H3;(H,3,4)(H,5,6)