ethyl 4-[(3-iodanyl-5-methyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]benzoate

Systemtic Name: ethyl 4-[(3-iodanyl-5-methyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]benzoate Openeye Name: ethyl 4-[(3-iodo-5-methyl-6-oxo-cyclohexa-2,4-dien-1-ylidene)methylamino]benzoate CAS Name: 4-[(3-iodo-5-methyl-6-oxo-1-cyclohexa-2,4-dienylidene)methylamino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(3-iodo-5-methyl-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]benzoate Traditional Name: 4-[(3-iodo-6-keto-5-methyl-cyclohexa-2,4-dien-1-ylidene)methylamino]benzoic acid ethyl ester Formula: C17H16INO3 MolecularWeight: 409.21831

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC=C2C=C(C=C(C2=O)C)I

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC=C2C=C(C=C(C2=O)C)I

InChI

InChI=1S/C17H16INO3/c1-3-22-17(21)12-4-6-15(7-5-12)19-10-13-9-14(18)8-11(2)16(13)20/h4-10,19H,3H2,1-2H3