tert-butyl N-[4-[5-chloranyl-1,3-bis(oxidanylidene)isoindol-2-yl]-3-methyl-phenyl]carbamate

Systemtic Name: tert-butyl N-[4-[5-chloranyl-1,3-bis(oxidanylidene)isoindol-2-yl]-3-methyl-phenyl]carbamate Openeye Name: tert-butyl N-[4-(5-chloro-1,3-dioxo-isoindolin-2-yl)-3-methyl-phenyl]carbamate CAS Name: N-[4-(5-chloro-1,3-dioxo-2-isoindolyl)-3-methylphenyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[4-(5-chloro-1,3-dioxoisoindol-2-yl)-3-methylphenyl]carbamate Traditional Name: N-[4-(5-chloro-1,3-diketo-isoindolin-2-yl)-3-methyl-phenyl]carbamic acid tert-butyl ester Formula: C20H19ClN2O4 MolecularWeight: 386.82886

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)OC(C)(C)C)N2C(=O)C3=C(C2=O)C=C(C=C3)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)OC(C)(C)C)N2C(=O)C3=C(C2=O)C=C(C=C3)Cl

InChI

InChI=1S/C20H19ClN2O4/c1-11-9-13(22-19(26)27-20(2,3)4)6-8-16(11)23-17(24)14-7-5-12(21)10-15(14)18(23)25/h5-10H,1-4H3,(H,22,26)