4-oxidanylidene-4-[[4-oxidanylidene-9-(4-phenylpiperazin-1-yl)carbonyl-pyrido[1,2-a]pyrimidin-3-yl]amino]butanoic acid

Systemtic Name: 4-oxidanylidene-4-[[4-oxidanylidene-9-(4-phenylpiperazin-1-yl)carbonyl-pyrido[1,2-a]pyrimidin-3-yl]amino]butanoic acid Openeye Name: 4-oxo-4-[[4-oxo-9-(4-phenylpiperazine-1-carbonyl)pyrido[1,2-a]pyrimidin-3-yl]amino]butanoic acid CAS Name: 4-oxo-4-[[4-oxo-9-[oxo-(4-phenyl-1-piperazinyl)methyl]-3-pyrido[1,2-a]pyrimidinyl]amino]butanoic acid IUPAC Name: 4-oxo-4-[[4-oxo-9-(4-phenylpiperazine-1-carbonyl)pyrido[1,2-a]pyrimidin-3-yl]amino]butanoic acid Traditional Name: 4-keto-4-[[4-keto-9-(4-phenylpiperazine-1-carbonyl)pyrido[1,2-a]pyrimidin-3-yl]amino]butyric acid Formula: C23H23N5O5 MolecularWeight: 449.45922

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C(=O)C3=CC=CN4C3=NC=C(C4=O)NC(=O)CCC(=O)O

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C(=O)C3=CC=CN4C3=NC=C(C4=O)NC(=O)CCC(=O)O

InChI

InChI=1S/C23H23N5O5/c29-19(8-9-20(30)31)25-18-15-24-21-17(7-4-10-28(21)23(18)33)22(32)27-13-11-26(12-14-27)16-5-2-1-3-6-16/h1-7,10,15H,8-9,11-14H2,(H,25,29)(H,30,31)