ethyl 4-[3-[(3-oxidanylidene-1,4-benzoxazin-4-yl)methyl]phenyl]carbonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-[3-[(3-oxidanylidene-1,4-benzoxazin-4-yl)methyl]phenyl]carbonylpiperazine-1-carboxylate Openeye Name: ethyl 4-[3-[(3-oxo-1,4-benzoxazin-4-yl)methyl]benzoyl]piperazine-1-carboxylate CAS Name: 4-[oxo-[3-[(3-oxo-1,4-benzoxazin-4-yl)methyl]phenyl]methyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[3-[(3-oxo-1,4-benzoxazin-4-yl)methyl]benzoyl]piperazine-1-carboxylate Traditional Name: 4-[3-[(3-keto-1,4-benzoxazin-4-yl)methyl]benzoyl]piperazine-1-carboxylic acid ethyl ester Formula: C23H25N3O5 MolecularWeight: 423.4617

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C2=CC(=CC=C2)CN3C(=O)COC4=CC=CC=C43

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C2=CC(=CC=C2)CN3C(=O)COC4=CC=CC=C43

InChI

InChI=1S/C23H25N3O5/c1-2-30-23(29)25-12-10-24(11-13-25)22(28)18-7-5-6-17(14-18)15-26-19-8-3-4-9-20(19)31-16-21(26)27/h3-9,14H,2,10-13,15-16H2,1H3