2-[4-[4-oxidanylidene-6-(4-phenylpiperazin-1-yl)carbonyl-pyran-2-yl]carbonylpiperazin-1-yl]ethanoic acid

Systemtic Name: 2-[4-[4-oxidanylidene-6-(4-phenylpiperazin-1-yl)carbonyl-pyran-2-yl]carbonylpiperazin-1-yl]ethanoic acid Openeye Name: 2-[4-[4-oxo-6-(4-phenylpiperazine-1-carbonyl)pyran-2-carbonyl]piperazin-1-yl]acetic acid CAS Name: 2-[4-[oxo-[4-oxo-6-[oxo-(4-phenyl-1-piperazinyl)methyl]-2-pyranyl]methyl]-1-piperazinyl]acetic acid IUPAC Name: 2-[4-[4-oxo-6-(4-phenylpiperazine-1-carbonyl)pyran-2-carbonyl]piperazin-1-yl]acetic acid Traditional Name: 2-[4-[4-keto-6-(4-phenylpiperazine-1-carbonyl)pyran-2-carbonyl]piperazino]acetic acid Formula: C23H26N4O6 MolecularWeight: 454.47574

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(=O)O)C(=O)C2=CC(=O)C=C(O2)C(=O)N3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1CC(=O)O)C(=O)C2=CC(=O)C=C(O2)C(=O)N3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C23H26N4O6/c28-18-14-19(22(31)26-8-6-24(7-9-26)16-21(29)30)33-20(15-18)23(32)27-12-10-25(11-13-27)17-4-2-1-3-5-17/h1-5,14-15H,6-13,16H2,(H,29,30)