3-bromanyl-4-(3-methylbutoxy)-N-[4-(3-phenylpropanoylamino)phenyl]benzamide

Systemtic Name: 3-bromanyl-4-(3-methylbutoxy)-N-[4-(3-phenylpropanoylamino)phenyl]benzamide Openeye Name: 3-bromo-4-isopentyloxy-N-[4-(3-phenylpropanoylamino)phenyl]benzamide CAS Name: 3-bromo-4-(3-methylbutoxy)-N-[4-[(1-oxo-3-phenylpropyl)amino]phenyl]benzamide IUPAC Name: 3-bromo-4-(3-methylbutoxy)-N-[4-(3-phenylpropanoylamino)phenyl]benzamide Traditional Name: 3-bromo-N-[4-(hydrocinnamoylamino)phenyl]-4-isoamoxy-benzamide Formula: C27H29BrN2O3 MolecularWeight: 509.43476

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)NC(=O)CCC3=CC=CC=C3)Br

Isomeric SMILES

CC(C)CCOC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)NC(=O)CCC3=CC=CC=C3)Br

InChI

InChI=1S/C27H29BrN2O3/c1-19(2)16-17-33-25-14-9-21(18-24(25)28)27(32)30-23-12-10-22(11-13-23)29-26(31)15-8-20-6-4-3-5-7-20/h3-7,9-14,18-19H,8,15-17H2,1-2H3,(H,29,31)(H,30,32)