N-[(E)-(3-bromanyl-4-methoxy-5-oxidanyl-phenyl)methylideneamino]-1-[(4-bromophenyl)methyl]piperidine-4-carboxamide

Systemtic Name: N-[(E)-(3-bromanyl-4-methoxy-5-oxidanyl-phenyl)methylideneamino]-1-[(4-bromophenyl)methyl]piperidine-4-carboxamide Openeye Name: N-[(E)-(3-bromo-5-hydroxy-4-methoxy-phenyl)methyleneamino]-1-[(4-bromophenyl)methyl]piperidine-4-carboxamide CAS Name: N-[(E)-(3-bromo-5-hydroxy-4-methoxyphenyl)methylideneamino]-1-[(4-bromophenyl)methyl]-4-piperidinecarboxamide IUPAC Name: N-[(E)-(3-bromo-5-hydroxy-4-methoxyphenyl)methylideneamino]-1-[(4-bromophenyl)methyl]piperidine-4-carboxamide Traditional Name: 1-(4-bromobenzyl)-N-[(E)-(3-bromo-5-hydroxy-4-methoxy-benzylidene)amino]isonipecotamide Formula: C21H23Br2N3O3 MolecularWeight: 525.23362

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1Br)C=NNC(=O)C2CCN(CC2)CC3=CC=C(C=C3)Br)O

Isomeric SMILES

COC1=C(C=C(C=C1Br)/C=N/NC(=O)C2CCN(CC2)CC3=CC=C(C=C3)Br)O

InChI

InChI=1S/C21H23Br2N3O3/c1-29-20-18(23)10-15(11-19(20)27)12-24-25-21(28)16-6-8-26(9-7-16)13-14-2-4-17(22)5-3-14/h2-5,10-12,16,27H,6-9,13H2,1H3,(H,25,28)/b24-12+