3-bromanyl-4-(oxolan-2-ylmethoxy)-N-[4-(3-phenylpropanoylamino)phenyl]benzamide

Systemtic Name: 3-bromanyl-4-(oxolan-2-ylmethoxy)-N-[4-(3-phenylpropanoylamino)phenyl]benzamide Openeye Name: 3-bromo-N-[4-(3-phenylpropanoylamino)phenyl]-4-(tetrahydrofuran-2-ylmethoxy)benzamide CAS Name: 3-bromo-4-(2-oxolanylmethoxy)-N-[4-[(1-oxo-3-phenylpropyl)amino]phenyl]benzamide IUPAC Name: 3-bromo-4-(oxolan-2-ylmethoxy)-N-[4-(3-phenylpropanoylamino)phenyl]benzamide Traditional Name: 3-bromo-N-[4-(hydrocinnamoylamino)phenyl]-4-(tetrahydrofurfuryloxy)benzamide Formula: C27H27BrN2O4 MolecularWeight: 523.41828

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)COC2=C(C=C(C=C2)C(=O)NC3=CC=C(C=C3)NC(=O)CCC4=CC=CC=C4)Br

Isomeric SMILES

C1CC(OC1)COC2=C(C=C(C=C2)C(=O)NC3=CC=C(C=C3)NC(=O)CCC4=CC=CC=C4)Br

InChI

InChI=1S/C27H27BrN2O4/c28-24-17-20(9-14-25(24)34-18-23-7-4-16-33-23)27(32)30-22-12-10-21(11-13-22)29-26(31)15-8-19-5-2-1-3-6-19/h1-3,5-6,9-14,17,23H,4,7-8,15-16,18H2,(H,29,31)(H,30,32)