(3S)-1-([1]benzofuro[3,2-d]pyrimidin-4-yl)piperidine-3-carboxylate

Systemtic Name: (3S)-1-([1]benzofuro[3,2-d]pyrimidin-4-yl)piperidine-3-carboxylate Openeye Name: (3S)-1-(benzofuro[3,2-d]pyrimidin-4-yl)piperidine-3-carboxylate CAS Name: (3S)-1-(4-benzofuro[3,2-d]pyrimidinyl)-3-piperidinecarboxylate IUPAC Name: (3S)-1-([1]benzofuro[3,2-d]pyrimidin-4-yl)piperidine-3-carboxylate Traditional Name: (3S)-1-(benzofuro[3,2-d]pyrimidin-4-yl)nipecotate Formula: C16H14N3O3- MolecularWeight: 296.30066

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2=NC=NC3=C2OC4=CC=CC=C43)C(=O)[O-]

Isomeric SMILES

C1C[C@@H](CN(C1)C2=NC=NC3=C2OC4=CC=CC=C43)C(=O)[O-]

InChI

InChI=1S/C16H15N3O3/c20-16(21)10-4-3-7-19(8-10)15-14-13(17-9-18-15)11-5-1-2-6-12(11)22-14/h1-2,5-6,9-10H,3-4,7-8H2,(H,20,21)/p-1/t10-/m0/s1