tert-butyl N-[(3-iodanyl-5-methyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]carbamate

Systemtic Name: tert-butyl N-[(3-iodanyl-5-methyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]carbamate Openeye Name: tert-butyl N-[(3-iodo-5-methyl-6-oxo-cyclohexa-2,4-dien-1-ylidene)methylamino]carbamate CAS Name: N-[(3-iodo-5-methyl-6-oxo-1-cyclohexa-2,4-dienylidene)methylamino]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(3-iodo-5-methyl-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]carbamate Traditional Name: N-[(3-iodo-6-keto-5-methyl-cyclohexa-2,4-dien-1-ylidene)methylamino]carbamic acid tert-butyl ester Formula: C13H17IN2O3 MolecularWeight: 376.19015

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=CNNC(=O)OC(C)(C)C)C1=O)I

Isomeric SMILES

CC1=CC(=CC(=CNNC(=O)OC(C)(C)C)C1=O)I

InChI

InChI=1S/C13H17IN2O3/c1-8-5-10(14)6-9(11(8)17)7-15-16-12(18)19-13(2,3)4/h5-7,15H,1-4H3,(H,16,18)