[2-[(4-iodophenyl)amino]-2-oxidanylidene-ethyl] 2,6-dimethoxybenzoate

Systemtic Name: [2-[(4-iodophenyl)amino]-2-oxidanylidene-ethyl] 2,6-dimethoxybenzoate Openeye Name: [2-(4-iodoanilino)-2-oxo-ethyl] 2,6-dimethoxybenzoate CAS Name: 2,6-dimethoxybenzoic acid [2-(4-iodoanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-iodoanilino)-2-oxoethyl] 2,6-dimethoxybenzoate Traditional Name: 2,6-dimethoxybenzoic acid [2-(4-iodoanilino)-2-keto-ethyl] ester Formula: C17H16INO5 MolecularWeight: 441.21711

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC=C1)OC)C(=O)OCC(=O)NC2=CC=C(C=C2)I

Isomeric SMILES

COC1=C(C(=CC=C1)OC)C(=O)OCC(=O)NC2=CC=C(C=C2)I

InChI

InChI=1S/C17H16INO5/c1-22-13-4-3-5-14(23-2)16(13)17(21)24-10-15(20)19-12-8-6-11(18)7-9-12/h3-9H,10H2,1-2H3,(H,19,20)