tert-butyl 4-[(8-methyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[(8-methyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[(7-hydroxy-8-methyl-2-oxo-chromen-4-yl)methyl]piperazine-1-carboxylate CAS Name: 4-[(7-hydroxy-8-methyl-2-oxo-1-benzopyran-4-yl)methyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[(7-hydroxy-8-methyl-2-oxochromen-4-yl)methyl]piperazine-1-carboxylate Traditional Name: 4-[(7-hydroxy-2-keto-8-methyl-chromen-4-yl)methyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C20H26N2O5 MolecularWeight: 374.43084

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1OC(=O)C=C2CN3CCN(CC3)C(=O)OC(C)(C)C)O

Isomeric SMILES

CC1=C(C=CC2=C1OC(=O)C=C2CN3CCN(CC3)C(=O)OC(C)(C)C)O

InChI

InChI=1S/C20H26N2O5/c1-13-16(23)6-5-15-14(11-17(24)26-18(13)15)12-21-7-9-22(10-8-21)19(25)27-20(2,3)4/h5-6,11,23H,7-10,12H2,1-4H3