methyl 2-[(4-bromanyl-2-fluoranyl-phenyl)carbamoylamino]-3-(4-fluorophenyl)propanoate

Systemtic Name: methyl 2-[(4-bromanyl-2-fluoranyl-phenyl)carbamoylamino]-3-(4-fluorophenyl)propanoate Openeye Name: methyl 2-[(4-bromo-2-fluoro-phenyl)carbamoylamino]-3-(4-fluorophenyl)propanoate CAS Name: 2-[[(4-bromo-2-fluoroanilino)-oxomethyl]amino]-3-(4-fluorophenyl)propanoic acid methyl ester IUPAC Name: methyl 2-[(4-bromo-2-fluorophenyl)carbamoylamino]-3-(4-fluorophenyl)propanoate Traditional Name: 2-[(4-bromo-2-fluoro-phenyl)carbamoylamino]-3-(4-fluorophenyl)propionic acid methyl ester Formula: C17H15BrF2N2O3 MolecularWeight: 413.213406

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=C(C=C1)F)NC(=O)NC2=C(C=C(C=C2)Br)F

Isomeric SMILES

COC(=O)C(CC1=CC=C(C=C1)F)NC(=O)NC2=C(C=C(C=C2)Br)F

InChI

InChI=1S/C17H15BrF2N2O3/c1-25-16(23)15(8-10-2-5-12(19)6-3-10)22-17(24)21-14-7-4-11(18)9-13(14)20/h2-7,9,15H,8H2,1H3,(H2,21,22,24)