4-phenylmethoxycarbonyl-1-(pyridin-3-ylmethyl)piperazine-2-carboxylic acid

Systemtic Name: 4-phenylmethoxycarbonyl-1-(pyridin-3-ylmethyl)piperazine-2-carboxylic acid Openeye Name: 4-benzyloxycarbonyl-1-(3-pyridylmethyl)piperazine-2-carboxylic acid CAS Name: 4-phenylmethoxycarbonyl-1-(3-pyridinylmethyl)-2-piperazinecarboxylic acid IUPAC Name: 4-phenylmethoxycarbonyl-1-(pyridin-3-ylmethyl)piperazine-2-carboxylic acid Traditional Name: 4-carbobenzoxy-1-(3-pyridylmethyl)piperazine-2-carboxylic acid Formula: C19H21N3O4 MolecularWeight: 355.38774

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(CN1C(=O)OCC2=CC=CC=C2)C(=O)O)CC3=CN=CC=C3

Isomeric SMILES

C1CN(C(CN1C(=O)OCC2=CC=CC=C2)C(=O)O)CC3=CN=CC=C3

InChI

InChI=1S/C19H21N3O4/c23-18(24)17-13-22(19(25)26-14-15-5-2-1-3-6-15)10-9-21(17)12-16-7-4-8-20-11-16/h1-8,11,17H,9-10,12-14H2,(H,23,24)