(Z)-3-[4-(2-bromanylphenoxy)phenyl]-2-(3-phenylpentanoylamino)prop-2-enoic acid

Systemtic Name: (Z)-3-[4-(2-bromanylphenoxy)phenyl]-2-(3-phenylpentanoylamino)prop-2-enoic acid Openeye Name: (Z)-3-[4-(2-bromophenoxy)phenyl]-2-(3-phenylpentanoylamino)prop-2-enoic acid CAS Name: (Z)-3-[4-(2-bromophenoxy)phenyl]-2-[(1-oxo-3-phenylpentyl)amino]-2-propenoic acid IUPAC Name: (Z)-3-[4-(2-bromophenoxy)phenyl]-2-(3-phenylpentanoylamino)prop-2-enoic acid Traditional Name: (Z)-3-[4-(2-bromophenoxy)phenyl]-2-(3-phenylpentanoylamino)acrylic acid Formula: C26H24BrNO4 MolecularWeight: 494.37706

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC(=O)NC(=CC1=CC=C(C=C1)OC2=CC=CC=C2Br)C(=O)O)C3=CC=CC=C3

Isomeric SMILES

CCC(CC(=O)N/C(=C\C1=CC=C(C=C1)OC2=CC=CC=C2Br)/C(=O)O)C3=CC=CC=C3

InChI

InChI=1S/C26H24BrNO4/c1-2-19(20-8-4-3-5-9-20)17-25(29)28-23(26(30)31)16-18-12-14-21(15-13-18)32-24-11-7-6-10-22(24)27/h3-16,19H,2,17H2,1H3,(H,28,29)(H,30,31)/b23-16-