4-[(5-bromanyl-2-phenylmethoxy-phenyl)methyl-ethyl-amino]-N-(pyridin-3-ylmethyl)benzamide

Systemtic Name: 4-[(5-bromanyl-2-phenylmethoxy-phenyl)methyl-ethyl-amino]-N-(pyridin-3-ylmethyl)benzamide Openeye Name: 4-[(2-benzyloxy-5-bromo-phenyl)methyl-ethyl-amino]-N-(3-pyridylmethyl)benzamide CAS Name: 4-[(5-bromo-2-phenylmethoxyphenyl)methyl-ethylamino]-N-(3-pyridinylmethyl)benzamide IUPAC Name: 4-[(5-bromo-2-phenylmethoxyphenyl)methyl-ethylamino]-N-(pyridin-3-ylmethyl)benzamide Traditional Name: 4-[(2-benzoxy-5-bromo-benzyl)-ethyl-amino]-N-(3-pyridylmethyl)benzamide Formula: C29H28BrN3O2 MolecularWeight: 530.45552

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=C(C=CC(=C1)Br)OCC2=CC=CC=C2)C3=CC=C(C=C3)C(=O)NCC4=CN=CC=C4

Isomeric SMILES

CCN(CC1=C(C=CC(=C1)Br)OCC2=CC=CC=C2)C3=CC=C(C=C3)C(=O)NCC4=CN=CC=C4

InChI

InChI=1S/C29H28BrN3O2/c1-2-33(20-25-17-26(30)12-15-28(25)35-21-22-7-4-3-5-8-22)27-13-10-24(11-14-27)29(34)32-19-23-9-6-16-31-18-23/h3-18H,2,19-21H2,1H3,(H,32,34)