1-[4-[(8-cyclohexyl-7-oxidanylidene-pyrido[2,3-d]pyrimidin-2-yl)amino]phenyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[4-[(8-cyclohexyl-7-oxidanylidene-pyrido[2,3-d]pyrimidin-2-yl)amino]phenyl]piperidine-4-carboxylic acid Openeye Name: 1-[4-[(8-cyclohexyl-7-oxo-pyrido[2,3-d]pyrimidin-2-yl)amino]phenyl]piperidine-4-carboxylic acid CAS Name: 1-[4-[(8-cyclohexyl-7-oxo-2-pyrido[2,3-d]pyrimidinyl)amino]phenyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[4-[(8-cyclohexyl-7-oxopyrido[2,3-d]pyrimidin-2-yl)amino]phenyl]piperidine-4-carboxylic acid Traditional Name: 1-[4-[(8-cyclohexyl-7-keto-pyrido[2,3-d]pyrimidin-2-yl)amino]phenyl]isonipecotic acid Formula: C25H29N5O3 MolecularWeight: 447.52946

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C(=O)C=CC3=CN=C(N=C32)NC4=CC=C(C=C4)N5CCC(CC5)C(=O)O

Isomeric SMILES

C1CCC(CC1)N2C(=O)C=CC3=CN=C(N=C32)NC4=CC=C(C=C4)N5CCC(CC5)C(=O)O

InChI

InChI=1S/C25H29N5O3/c31-22-11-6-18-16-26-25(28-23(18)30(22)21-4-2-1-3-5-21)27-19-7-9-20(10-8-19)29-14-12-17(13-15-29)24(32)33/h6-11,16-17,21H,1-5,12-15H2,(H,32,33)(H,26,27,28)