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

Systemtic Name: N-[3-(2-bromanyl-4-methyl-phenoxy)propyl]-3-methoxy-propan-1-amine; ethanedioic acid Openeye Name: N-[3-(2-bromo-4-methyl-phenoxy)propyl]-3-methoxy-propan-1-amine; oxalic acid CAS Name: N-[3-(2-bromo-4-methylphenoxy)propyl]-3-methoxy-1-propanamine; oxalic acid IUPAC Name: N-[3-(2-bromo-4-methylphenoxy)propyl]-3-methoxypropan-1-amine; oxalic acid Traditional Name: 3-(2-bromo-4-methyl-phenoxy)propyl-(3-methoxypropyl)amine; oxalic acid Formula: C16H24BrNO6 MolecularWeight: 406.26886

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H22BrNO2.C2H2O4/c1-12-5-6-14(13(15)11-12)18-10-4-8-16-7-3-9-17-2;3-1(4)2(5)6/h5-6,11,16H,3-4,7-10H2,1-2H3;(H,3,4)(H,5,6)