[2-[(4-iodanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl] 3,4-dimethoxybenzoate

Systemtic Name: [2-[(4-iodanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl] 3,4-dimethoxybenzoate Openeye Name: [2-(4-iodo-2-methyl-anilino)-2-oxo-ethyl] 3,4-dimethoxybenzoate CAS Name: 3,4-dimethoxybenzoic acid [2-(4-iodo-2-methylanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-iodo-2-methylanilino)-2-oxoethyl] 3,4-dimethoxybenzoate Traditional Name: 3,4-dimethoxybenzoic acid [2-(4-iodo-2-methyl-anilino)-2-keto-ethyl] ester Formula: C18H18INO5 MolecularWeight: 455.24369

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)I)NC(=O)COC(=O)C2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CC1=C(C=CC(=C1)I)NC(=O)COC(=O)C2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C18H18INO5/c1-11-8-13(19)5-6-14(11)20-17(21)10-25-18(22)12-4-7-15(23-2)16(9-12)24-3/h4-9H,10H2,1-3H3,(H,20,21)