N-[[3,5-bis(bromanyl)-4-propoxy-phenyl]methyl]-3-chloranyl-aniline

Systemtic Name: N-[[3,5-bis(bromanyl)-4-propoxy-phenyl]methyl]-3-chloranyl-aniline Openeye Name: 3-chloro-N-[(3,5-dibromo-4-propoxy-phenyl)methyl]aniline CAS Name: 3-chloro-N-[(3,5-dibromo-4-propoxyphenyl)methyl]aniline IUPAC Name: 3-chloro-N-[(3,5-dibromo-4-propoxyphenyl)methyl]aniline Traditional Name: (3-chlorophenyl)-(3,5-dibromo-4-propoxy-benzyl)amine Formula: C16H16Br2ClNO MolecularWeight: 433.56534

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1Br)CNC2=CC(=CC=C2)Cl)Br

Isomeric SMILES

CCCOC1=C(C=C(C=C1Br)CNC2=CC(=CC=C2)Cl)Br

InChI

InChI=1S/C16H16Br2ClNO/c1-2-6-21-16-14(17)7-11(8-15(16)18)10-20-13-5-3-4-12(19)9-13/h3-5,7-9,20H,2,6,10H2,1H3