3-[[2-[(4-chlorophenyl)methylamino]-5-iodanyl-phenyl]carbonylamino]propanoate

Systemtic Name: 3-[[2-[(4-chlorophenyl)methylamino]-5-iodanyl-phenyl]carbonylamino]propanoate Openeye Name: 3-[[2-[(4-chlorophenyl)methylamino]-5-iodo-benzoyl]amino]propanoate CAS Name: 3-[[[2-[(4-chlorophenyl)methylamino]-5-iodophenyl]-oxomethyl]amino]propanoate IUPAC Name: 3-[[2-[(4-chlorophenyl)methylamino]-5-iodobenzoyl]amino]propanoate Traditional Name: 3-[[2-[(4-chlorobenzyl)amino]-5-iodo-benzoyl]amino]propionate Formula: C17H15ClIN2O3- MolecularWeight: 457.67007

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNC2=C(C=C(C=C2)I)C(=O)NCCC(=O)[O-])Cl

Isomeric SMILES

C1=CC(=CC=C1CNC2=C(C=C(C=C2)I)C(=O)NCCC(=O)[O-])Cl

InChI

InChI=1S/C17H16ClIN2O3/c18-12-3-1-11(2-4-12)10-21-15-6-5-13(19)9-14(15)17(24)20-8-7-16(22)23/h1-6,9,21H,7-8,10H2,(H,20,24)(H,22,23)/p-1