prop-2-ynyl 5-[(4-iodophenyl)amino]-5-oxidanylidene-pentanoate

Systemtic Name: prop-2-ynyl 5-[(4-iodophenyl)amino]-5-oxidanylidene-pentanoate Openeye Name: prop-2-ynyl 5-(4-iodoanilino)-5-oxo-pentanoate CAS Name: 5-(4-iodoanilino)-5-oxopentanoic acid prop-2-ynyl ester IUPAC Name: prop-2-ynyl 5-(4-iodoanilino)-5-oxopentanoate Traditional Name: 5-(4-iodoanilino)-5-keto-valeric acid propargyl ester Formula: C14H14INO3 MolecularWeight: 371.17033

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C#CCOC(=O)CCCC(=O)NC1=CC=C(C=C1)I

Isomeric SMILES

C#CCOC(=O)CCCC(=O)NC1=CC=C(C=C1)I

InChI

InChI=1S/C14H14INO3/c1-2-10-19-14(18)5-3-4-13(17)16-12-8-6-11(15)7-9-12/h1,6-9H,3-5,10H2,(H,16,17)