(3-bromanyl-5-ethoxy-4-pentoxy-phenyl)methanamine

Systemtic Name: (3-bromanyl-5-ethoxy-4-pentoxy-phenyl)methanamine Openeye Name: (3-bromo-5-ethoxy-4-pentoxy-phenyl)methanamine CAS Name: (3-bromo-5-ethoxy-4-pentoxyphenyl)methanamine IUPAC Name: (3-bromo-5-ethoxy-4-pentoxyphenyl)methanamine Traditional Name: (4-amoxy-3-bromo-5-ethoxy-benzyl)amine Formula: C14H22BrNO2 MolecularWeight: 316.23398

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=C(C=C(C=C1Br)CN)OCC

Isomeric SMILES

CCCCCOC1=C(C=C(C=C1Br)CN)OCC

InChI

InChI=1S/C14H22BrNO2/c1-3-5-6-7-18-14-12(15)8-11(10-16)9-13(14)17-4-2/h8-9H,3-7,10,16H2,1-2H3