N-[[3-bromanyl-4-[(4-chlorophenyl)methoxy]-5-ethoxy-phenyl]methyl]-3-ethoxy-propan-1-amine

Systemtic Name: N-[[3-bromanyl-4-[(4-chlorophenyl)methoxy]-5-ethoxy-phenyl]methyl]-3-ethoxy-propan-1-amine Openeye Name: N-[[3-bromo-4-[(4-chlorophenyl)methoxy]-5-ethoxy-phenyl]methyl]-3-ethoxy-propan-1-amine CAS Name: N-[[3-bromo-4-[(4-chlorophenyl)methoxy]-5-ethoxyphenyl]methyl]-3-ethoxy-1-propanamine IUPAC Name: N-[[3-bromo-4-[(4-chlorophenyl)methoxy]-5-ethoxyphenyl]methyl]-3-ethoxypropan-1-amine Traditional Name: [3-bromo-4-(4-chlorobenzyl)oxy-5-ethoxy-benzyl]-(3-ethoxypropyl)amine Formula: C21H27BrClNO3 MolecularWeight: 456.80098

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCNCC1=CC(=C(C(=C1)Br)OCC2=CC=C(C=C2)Cl)OCC

Isomeric SMILES

CCOCCCNCC1=CC(=C(C(=C1)Br)OCC2=CC=C(C=C2)Cl)OCC

InChI

InChI=1S/C21H27BrClNO3/c1-3-25-11-5-10-24-14-17-12-19(22)21(20(13-17)26-4-2)27-15-16-6-8-18(23)9-7-16/h6-9,12-13,24H,3-5,10-11,14-15H2,1-2H3