tert-butyl N-[5-acetamido-2,7-bis(chloranyl)-9,9-dimethyl-xanthen-4-yl]carbamate

Systemtic Name: tert-butyl N-[5-acetamido-2,7-bis(chloranyl)-9,9-dimethyl-xanthen-4-yl]carbamate Openeye Name: tert-butyl N-(5-acetamido-2,7-dichloro-9,9-dimethyl-xanthen-4-yl)carbamate CAS Name: N-(5-acetamido-2,7-dichloro-9,9-dimethyl-4-xanthenyl)carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-(5-acetamido-2,7-dichloro-9,9-dimethylxanthen-4-yl)carbamate Traditional Name: N-(5-acetamido-2,7-dichloro-9,9-dimethyl-xanthen-4-yl)carbamic acid tert-butyl ester Formula: C22H24Cl2N2O4 MolecularWeight: 451.34296

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C2C(=CC(=C1)Cl)C(C3=CC(=CC(=C3O2)NC(=O)OC(C)(C)C)Cl)(C)C

Isomeric SMILES

CC(=O)NC1=C2C(=CC(=C1)Cl)C(C3=CC(=CC(=C3O2)NC(=O)OC(C)(C)C)Cl)(C)C

InChI

InChI=1S/C22H24Cl2N2O4/c1-11(27)25-16-9-12(23)7-14-18(16)29-19-15(22(14,5)6)8-13(24)10-17(19)26-20(28)30-21(2,3)4/h7-10H,1-6H3,(H,25,27)(H,26,28)