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

Systemtic Name: 4-[4-azanyl-5-(4-hydroxyphenyl)pyrrolo[2,3-d]pyrimidin-7-yl]piperidine-1-carboxylic acid Openeye Name: 4-[4-amino-5-(4-hydroxyphenyl)pyrrolo[2,3-d]pyrimidin-7-yl]piperidine-1-carboxylic acid CAS Name: 4-[4-amino-5-(4-hydroxyphenyl)-7-pyrrolo[2,3-d]pyrimidinyl]-1-piperidinecarboxylic acid IUPAC Name: 4-[4-amino-5-(4-hydroxyphenyl)pyrrolo[2,3-d]pyrimidin-7-yl]piperidine-1-carboxylic acid Traditional Name: 4-[4-amino-5-(4-hydroxyphenyl)pyrrolo[2,3-d]pyrimidin-7-yl]piperidine-1-carboxylic acid Formula: C18H19N5O3 MolecularWeight: 353.37516

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19N5O3/c19-16-15-14(11-1-3-13(24)4-2-11)9-23(17(15)21-10-20-16)12-5-7-22(8-6-12)18(25)26/h1-4,9-10,12,24H,5-8H2,(H,25,26)(H2,19,20,21)