N-[(3-bromanyl-5-ethoxy-4-methoxy-phenyl)methyl]-1-phenyl-ethanamine

Systemtic Name: N-[(3-bromanyl-5-ethoxy-4-methoxy-phenyl)methyl]-1-phenyl-ethanamine Openeye Name: N-[(3-bromo-5-ethoxy-4-methoxy-phenyl)methyl]-1-phenyl-ethanamine CAS Name: N-[(3-bromo-5-ethoxy-4-methoxyphenyl)methyl]-1-phenylethanamine IUPAC Name: N-[(3-bromo-5-ethoxy-4-methoxyphenyl)methyl]-1-phenylethanamine Traditional Name: (3-bromo-5-ethoxy-4-methoxy-benzyl)-(1-phenylethyl)amine Formula: C18H22BrNO2 MolecularWeight: 364.27678

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)CNC(C)C2=CC=CC=C2)Br)OC

Isomeric SMILES

CCOC1=C(C(=CC(=C1)CNC(C)C2=CC=CC=C2)Br)OC

InChI

InChI=1S/C18H22BrNO2/c1-4-22-17-11-14(10-16(19)18(17)21-3)12-20-13(2)15-8-6-5-7-9-15/h5-11,13,20H,4,12H2,1-3H3