2-[(2-bromanyl-4-chloranyl-phenyl)carbonyl-[(5-bromanylfuran-2-yl)methyl]amino]-3-phenyl-propanoic acid

Systemtic Name: 2-[(2-bromanyl-4-chloranyl-phenyl)carbonyl-[(5-bromanylfuran-2-yl)methyl]amino]-3-phenyl-propanoic acid Openeye Name: 2-[(2-bromo-4-chloro-benzoyl)-[(5-bromo-2-furyl)methyl]amino]-3-phenyl-propanoic acid CAS Name: 2-[[(2-bromo-4-chlorophenyl)-oxomethyl]-[(5-bromo-2-furanyl)methyl]amino]-3-phenylpropanoic acid IUPAC Name: 2-[(2-bromo-4-chlorobenzoyl)-[(5-bromofuran-2-yl)methyl]amino]-3-phenylpropanoic acid Traditional Name: 2-[(2-bromo-4-chloro-benzoyl)-[(5-bromo-2-furyl)methyl]amino]-3-phenyl-propionic acid Formula: C21H16Br2ClNO4 MolecularWeight: 541.61704

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)O)N(CC2=CC=C(O2)Br)C(=O)C3=C(C=C(C=C3)Cl)Br

Isomeric SMILES

C1=CC=C(C=C1)CC(C(=O)O)N(CC2=CC=C(O2)Br)C(=O)C3=C(C=C(C=C3)Cl)Br

InChI

InChI=1S/C21H16Br2ClNO4/c22-17-11-14(24)6-8-16(17)20(26)25(12-15-7-9-19(23)29-15)18(21(27)28)10-13-4-2-1-3-5-13/h1-9,11,18H,10,12H2,(H,27,28)