[(2S)-1-[(4-fluorophenyl)amino]-1-oxidanylidene-propan-2-yl] 4-(aminocarbonylamino)benzoate

Systemtic Name: [(2S)-1-[(4-fluorophenyl)amino]-1-oxidanylidene-propan-2-yl] 4-(aminocarbonylamino)benzoate Openeye Name: [(1S)-2-(4-fluoroanilino)-1-methyl-2-oxo-ethyl] 4-ureidobenzoate CAS Name: 4-(carbamoylamino)benzoic acid [(2S)-1-(4-fluoroanilino)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(4-fluoroanilino)-1-oxopropan-2-yl] 4-(carbamoylamino)benzoate Traditional Name: 4-ureidobenzoic acid [(1S)-2-(4-fluoroanilino)-2-keto-1-methyl-ethyl] ester Formula: C17H16FN3O4 MolecularWeight: 345.325043

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)F)OC(=O)C2=CC=C(C=C2)NC(=O)N

Isomeric SMILES

C[C@@H](C(=O)NC1=CC=C(C=C1)F)OC(=O)C2=CC=C(C=C2)NC(=O)N

InChI

InChI=1S/C17H16FN3O4/c1-10(15(22)20-13-8-4-12(18)5-9-13)25-16(23)11-2-6-14(7-3-11)21-17(19)24/h2-10H,1H3,(H,20,22)(H3,19,21,24)/t10-/m0/s1