4-(4-azanyl-5-phenyl-pyrrolo[2,3-d]pyrimidin-7-yl)piperidine-1-carboxylic acid

Systemtic Name: 4-(4-azanyl-5-phenyl-pyrrolo[2,3-d]pyrimidin-7-yl)piperidine-1-carboxylic acid Openeye Name: 4-(4-amino-5-phenyl-pyrrolo[2,3-d]pyrimidin-7-yl)piperidine-1-carboxylic acid CAS Name: 4-(4-amino-5-phenyl-7-pyrrolo[2,3-d]pyrimidinyl)-1-piperidinecarboxylic acid IUPAC Name: 4-(4-amino-5-phenylpyrrolo[2,3-d]pyrimidin-7-yl)piperidine-1-carboxylic acid Traditional Name: 4-(4-amino-5-phenyl-pyrrolo[2,3-d]pyrimidin-7-yl)piperidine-1-carboxylic acid Formula: C18H19N5O2 MolecularWeight: 337.37576

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2C=C(C3=C2N=CN=C3N)C4=CC=CC=C4)C(=O)O

Isomeric SMILES

C1CN(CCC1N2C=C(C3=C2N=CN=C3N)C4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C18H19N5O2/c19-16-15-14(12-4-2-1-3-5-12)10-23(17(15)21-11-20-16)13-6-8-22(9-7-13)18(24)25/h1-5,10-11,13H,6-9H2,(H,24,25)(H2,19,20,21)