4-[(5-bromanyl-2-phenethyl-phenyl)methyl-ethyl-amino]-N-propyl-benzamide

Systemtic Name: 4-[(5-bromanyl-2-phenethyl-phenyl)methyl-ethyl-amino]-N-propyl-benzamide Openeye Name: 4-[(5-bromo-2-phenethyl-phenyl)methyl-ethyl-amino]-N-propyl-benzamide CAS Name: 4-[(5-bromo-2-phenethylphenyl)methyl-ethylamino]-N-propylbenzamide IUPAC Name: 4-[(5-bromo-2-phenethylphenyl)methyl-ethylamino]-N-propylbenzamide Traditional Name: 4-[(5-bromo-2-phenethyl-benzyl)-ethyl-amino]-N-propyl-benzamide Formula: C27H31BrN2O MolecularWeight: 479.45184

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1=CC=C(C=C1)N(CC)CC2=C(C=CC(=C2)Br)CCC3=CC=CC=C3

Isomeric SMILES

CCCNC(=O)C1=CC=C(C=C1)N(CC)CC2=C(C=CC(=C2)Br)CCC3=CC=CC=C3

InChI

InChI=1S/C27H31BrN2O/c1-3-18-29-27(31)23-13-16-26(17-14-23)30(4-2)20-24-19-25(28)15-12-22(24)11-10-21-8-6-5-7-9-21/h5-9,12-17,19H,3-4,10-11,18,20H2,1-2H3,(H,29,31)