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

Systemtic Name: 3-bromanyl-4-(3-methylbutoxy)-N-[3-(3-phenylpropanoylamino)phenyl]benzamide Openeye Name: 3-bromo-4-isopentyloxy-N-[3-(3-phenylpropanoylamino)phenyl]benzamide CAS Name: 3-bromo-4-(3-methylbutoxy)-N-[3-[(1-oxo-3-phenylpropyl)amino]phenyl]benzamide IUPAC Name: 3-bromo-4-(3-methylbutoxy)-N-[3-(3-phenylpropanoylamino)phenyl]benzamide Traditional Name: 3-bromo-N-[3-(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(=CC=C2)NC(=O)CCC3=CC=CC=C3)Br

Isomeric SMILES

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

InChI

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