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

Systemtic Name: methyl 2-[(4-bromanyl-2-methyl-phenyl)carbamoylamino]-3-(4-fluorophenyl)propanoate Openeye Name: methyl 2-[(4-bromo-2-methyl-phenyl)carbamoylamino]-3-(4-fluorophenyl)propanoate CAS Name: 2-[[(4-bromo-2-methylanilino)-oxomethyl]amino]-3-(4-fluorophenyl)propanoic acid methyl ester IUPAC Name: methyl 2-[(4-bromo-2-methylphenyl)carbamoylamino]-3-(4-fluorophenyl)propanoate Traditional Name: 2-[(4-bromo-2-methyl-phenyl)carbamoylamino]-3-(4-fluorophenyl)propionic acid methyl ester Formula: C18H18BrFN2O3 MolecularWeight: 409.249523

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)NC(CC2=CC=C(C=C2)F)C(=O)OC

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)NC(CC2=CC=C(C=C2)F)C(=O)OC

InChI

InChI=1S/C18H18BrFN2O3/c1-11-9-13(19)5-8-15(11)21-18(24)22-16(17(23)25-2)10-12-3-6-14(20)7-4-12/h3-9,16H,10H2,1-2H3,(H2,21,22,24)