1-(7-phenylpteridin-4-yl)piperidine-4-carboxylic acid

Systemtic Name: 1-(7-phenylpteridin-4-yl)piperidine-4-carboxylic acid Openeye Name: 1-(7-phenylpteridin-4-yl)piperidine-4-carboxylic acid CAS Name: 1-(7-phenyl-4-pteridinyl)-4-piperidinecarboxylic acid IUPAC Name: 1-(7-phenylpteridin-4-yl)piperidine-4-carboxylic acid Traditional Name: 1-(7-phenylpteridin-4-yl)isonipecotic acid Formula: C18H17N5O2 MolecularWeight: 335.35988

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)O)C2=NC=NC3=NC(=CN=C32)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1C(=O)O)C2=NC=NC3=NC(=CN=C32)C4=CC=CC=C4

InChI

InChI=1S/C18H17N5O2/c24-18(25)13-6-8-23(9-7-13)17-15-16(20-11-21-17)22-14(10-19-15)12-4-2-1-3-5-12/h1-5,10-11,13H,6-9H2,(H,24,25)