5-(3-phenylpropanoyl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxylate

Systemtic Name: 5-(3-phenylpropanoyl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxylate Openeye Name: 5-(3-phenylpropanoyl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxylate CAS Name: 5-(1-oxo-3-phenylpropyl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxylate IUPAC Name: 5-(3-phenylpropanoyl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxylate Traditional Name: 5-hydrocinnamoyl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxylate Formula: C16H16N3O3- MolecularWeight: 298.31654

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=C1NN=C2C(=O)[O-])C(=O)CCC3=CC=CC=C3

Isomeric SMILES

C1CN(CC2=C1NN=C2C(=O)[O-])C(=O)CCC3=CC=CC=C3

InChI

InChI=1S/C16H17N3O3/c20-14(7-6-11-4-2-1-3-5-11)19-9-8-13-12(10-19)15(16(21)22)18-17-13/h1-5H,6-10H2,(H,17,18)(H,21,22)/p-1