4-[4-methyl-7-oxidanylidene-2-(4-phenylpiperazin-1-yl)pyrido[2,3-d]pyrimidin-8-yl]benzoic acid

Systemtic Name: 4-[4-methyl-7-oxidanylidene-2-(4-phenylpiperazin-1-yl)pyrido[2,3-d]pyrimidin-8-yl]benzoic acid Openeye Name: 4-[4-methyl-7-oxo-2-(4-phenylpiperazin-1-yl)pyrido[2,3-d]pyrimidin-8-yl]benzoic acid CAS Name: 4-[4-methyl-7-oxo-2-(4-phenyl-1-piperazinyl)-8-pyrido[2,3-d]pyrimidinyl]benzoic acid IUPAC Name: 4-[4-methyl-7-oxo-2-(4-phenylpiperazin-1-yl)pyrido[2,3-d]pyrimidin-8-yl]benzoic acid Traditional Name: 4-[7-keto-4-methyl-2-(4-phenylpiperazino)pyrido[2,3-d]pyrimidin-8-yl]benzoic acid Formula: C25H23N5O3 MolecularWeight: 441.48182

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=CC(=O)N(C2=NC(=N1)N3CCN(CC3)C4=CC=CC=C4)C5=CC=C(C=C5)C(=O)O

Isomeric SMILES

CC1=C2C=CC(=O)N(C2=NC(=N1)N3CCN(CC3)C4=CC=CC=C4)C5=CC=C(C=C5)C(=O)O

InChI

InChI=1S/C25H23N5O3/c1-17-21-11-12-22(31)30(20-9-7-18(8-10-20)24(32)33)23(21)27-25(26-17)29-15-13-28(14-16-29)19-5-3-2-4-6-19/h2-12H,13-16H2,1H3,(H,32,33)