[1-[(4-fluorophenyl)amino]-1-oxidanylidene-butan-2-yl] 2-azanyl-5-iodanyl-benzoate

Systemtic Name: [1-[(4-fluorophenyl)amino]-1-oxidanylidene-butan-2-yl] 2-azanyl-5-iodanyl-benzoate Openeye Name: 1-[(4-fluorophenyl)carbamoyl]propyl 2-amino-5-iodo-benzoate CAS Name: 2-amino-5-iodobenzoic acid [1-(4-fluoroanilino)-1-oxobutan-2-yl] ester IUPAC Name: [1-(4-fluoroanilino)-1-oxobutan-2-yl] 2-amino-5-iodobenzoate Traditional Name: 2-amino-5-iodo-benzoic acid 1-[(4-fluorophenyl)carbamoyl]propyl ester Formula: C17H16FIN2O3 MolecularWeight: 442.223413

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16FIN2O3/c1-2-15(16(22)21-12-6-3-10(18)4-7-12)24-17(23)13-9-11(19)5-8-14(13)20/h3-9,15H,2,20H2,1H3,(H,21,22)