N-[(3-bromanyl-5-methoxy-4-prop-2-enoxy-phenyl)methyl]-2-chloranyl-aniline

Systemtic Name: N-[(3-bromanyl-5-methoxy-4-prop-2-enoxy-phenyl)methyl]-2-chloranyl-aniline Openeye Name: N-[(4-allyloxy-3-bromo-5-methoxy-phenyl)methyl]-2-chloro-aniline CAS Name: N-[(3-bromo-5-methoxy-4-prop-2-enoxyphenyl)methyl]-2-chloroaniline IUPAC Name: N-[(3-bromo-5-methoxy-4-prop-2-enoxyphenyl)methyl]-2-chloroaniline Traditional Name: (4-allyloxy-3-bromo-5-methoxy-benzyl)-(2-chlorophenyl)amine Formula: C17H17BrClNO2 MolecularWeight: 382.67938

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)CNC2=CC=CC=C2Cl)Br)OCC=C

Isomeric SMILES

COC1=C(C(=CC(=C1)CNC2=CC=CC=C2Cl)Br)OCC=C

InChI

InChI=1S/C17H17BrClNO2/c1-3-8-22-17-13(18)9-12(10-16(17)21-2)11-20-15-7-5-4-6-14(15)19/h3-7,9-10,20H,1,8,11H2,2H3