[4-(4-oxidanylidene-2-piperidin-1-yl-1H-pyrido[2,3-d]pyrimidin-5-yl)phenyl] 4-chloranylbenzoate

Systemtic Name: [4-(4-oxidanylidene-2-piperidin-1-yl-1H-pyrido[2,3-d]pyrimidin-5-yl)phenyl] 4-chloranylbenzoate Openeye Name: [4-[4-oxo-2-(1-piperidyl)-1H-pyrido[2,3-d]pyrimidin-5-yl]phenyl] 4-chlorobenzoate CAS Name: 4-chlorobenzoic acid [4-[4-oxo-2-(1-piperidinyl)-1H-pyrido[2,3-d]pyrimidin-5-yl]phenyl] ester IUPAC Name: [4-(4-oxo-2-piperidin-1-yl-1H-pyrido[2,3-d]pyrimidin-5-yl)phenyl] 4-chlorobenzoate Traditional Name: 4-chlorobenzoic acid [4-(4-keto-2-piperidino-1H-pyrido[2,3-d]pyrimidin-5-yl)phenyl] ester Formula: C25H21ClN4O3 MolecularWeight: 460.91224

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=NC(=O)C3=C(C=CN=C3N2)C4=CC=C(C=C4)OC(=O)C5=CC=C(C=C5)Cl

Isomeric SMILES

C1CCN(CC1)C2=NC(=O)C3=C(C=CN=C3N2)C4=CC=C(C=C4)OC(=O)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C25H21ClN4O3/c26-18-8-4-17(5-9-18)24(32)33-19-10-6-16(7-11-19)20-12-13-27-22-21(20)23(31)29-25(28-22)30-14-2-1-3-15-30/h4-13H,1-3,14-15H2,(H,27,28,29,31)