6-[(5-bromanyl-2-phenylmethoxy-phenyl)methyl-ethyl-amino]-N-methyl-N-propyl-pyridine-3-carboxamide

Systemtic Name: 6-[(5-bromanyl-2-phenylmethoxy-phenyl)methyl-ethyl-amino]-N-methyl-N-propyl-pyridine-3-carboxamide Openeye Name: 6-[(2-benzyloxy-5-bromo-phenyl)methyl-ethyl-amino]-N-methyl-N-propyl-pyridine-3-carboxamide CAS Name: 6-[(5-bromo-2-phenylmethoxyphenyl)methyl-ethylamino]-N-methyl-N-propyl-3-pyridinecarboxamide IUPAC Name: 6-[(5-bromo-2-phenylmethoxyphenyl)methyl-ethylamino]-N-methyl-N-propylpyridine-3-carboxamide Traditional Name: 6-[(2-benzoxy-5-bromo-benzyl)-ethyl-amino]-N-methyl-N-propyl-nicotinamide Formula: C26H30BrN3O2 MolecularWeight: 496.4393

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(C)C(=O)C1=CN=C(C=C1)N(CC)CC2=C(C=CC(=C2)Br)OCC3=CC=CC=C3

Isomeric SMILES

CCCN(C)C(=O)C1=CN=C(C=C1)N(CC)CC2=C(C=CC(=C2)Br)OCC3=CC=CC=C3

InChI

InChI=1S/C26H30BrN3O2/c1-4-15-29(3)26(31)21-11-14-25(28-17-21)30(5-2)18-22-16-23(27)12-13-24(22)32-19-20-9-7-6-8-10-20/h6-14,16-17H,4-5,15,18-19H2,1-3H3