ethyl 4-[5-[(6-methyl-3-oxidanylidene-1,4-benzoxazin-4-yl)methyl]furan-2-yl]carbonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-[5-[(6-methyl-3-oxidanylidene-1,4-benzoxazin-4-yl)methyl]furan-2-yl]carbonylpiperazine-1-carboxylate Openeye Name: ethyl 4-[5-[(6-methyl-3-oxo-1,4-benzoxazin-4-yl)methyl]furan-2-carbonyl]piperazine-1-carboxylate CAS Name: 4-[[5-[(6-methyl-3-oxo-1,4-benzoxazin-4-yl)methyl]-2-furanyl]-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[5-[(6-methyl-3-oxo-1,4-benzoxazin-4-yl)methyl]furan-2-carbonyl]piperazine-1-carboxylate Traditional Name: 4-[5-[(3-keto-6-methyl-1,4-benzoxazin-4-yl)methyl]-2-furoyl]piperazine-1-carboxylic acid ethyl ester Formula: C22H25N3O6 MolecularWeight: 427.4504

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C2=CC=C(O2)CN3C(=O)COC4=C3C=C(C=C4)C

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C2=CC=C(O2)CN3C(=O)COC4=C3C=C(C=C4)C

InChI

InChI=1S/C22H25N3O6/c1-3-29-22(28)24-10-8-23(9-11-24)21(27)19-7-5-16(31-19)13-25-17-12-15(2)4-6-18(17)30-14-20(25)26/h4-7,12H,3,8-11,13-14H2,1-2H3