7-(diethylamino)-N-[2-(2-iodanylethanoylamino)ethyl]-2-oxidanylidene-chromene-3-carboxamide

Systemtic Name: 7-(diethylamino)-N-[2-(2-iodanylethanoylamino)ethyl]-2-oxidanylidene-chromene-3-carboxamide Openeye Name: 7-(diethylamino)-N-[2-[(2-iodoacetyl)amino]ethyl]-2-oxo-chromene-3-carboxamide CAS Name: 7-(diethylamino)-N-[2-[(2-iodo-1-oxoethyl)amino]ethyl]-2-oxo-1-benzopyran-3-carboxamide IUPAC Name: 7-(diethylamino)-N-[2-[(2-iodoacetyl)amino]ethyl]-2-oxochromene-3-carboxamide Traditional Name: 7-(diethylamino)-N-[2-[(2-iodoacetyl)amino]ethyl]-2-keto-chromene-3-carboxamide Formula: C18H22IN3O4 MolecularWeight: 471.28945

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC2=C(C=C1)C=C(C(=O)O2)C(=O)NCCNC(=O)CI

Isomeric SMILES

CCN(CC)C1=CC2=C(C=C1)C=C(C(=O)O2)C(=O)NCCNC(=O)CI

InChI

InChI=1S/C18H22IN3O4/c1-3-22(4-2)13-6-5-12-9-14(18(25)26-15(12)10-13)17(24)21-8-7-20-16(23)11-19/h5-6,9-10H,3-4,7-8,11H2,1-2H3,(H,20,23)(H,21,24)