2-piperidin-3-ylcarbonyl-2-(piperidin-4-ylmethoxycarbonylamino)butanedioic acid

Systemtic Name: 2-piperidin-3-ylcarbonyl-2-(piperidin-4-ylmethoxycarbonylamino)butanedioic acid Openeye Name: 2-(piperidine-3-carbonyl)-2-(4-piperidylmethoxycarbonylamino)butanedioic acid CAS Name: 2-[[oxo(4-piperidinylmethoxy)methyl]amino]-2-[oxo(3-piperidinyl)methyl]butanedioic acid IUPAC Name: 2-(piperidine-3-carbonyl)-2-(piperidin-4-ylmethoxycarbonylamino)butanedioic acid Traditional Name: 2-nipecotoyl-2-(4-piperidylmethoxycarbonylamino)succinic acid Formula: C17H27N3O7 MolecularWeight: 385.41218

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CNC1)C(=O)C(CC(=O)O)(C(=O)O)NC(=O)OCC2CCNCC2

Isomeric SMILES

C1CC(CNC1)C(=O)C(CC(=O)O)(C(=O)O)NC(=O)OCC2CCNCC2

InChI

InChI=1S/C17H27N3O7/c21-13(22)8-17(15(24)25,14(23)12-2-1-5-19-9-12)20-16(26)27-10-11-3-6-18-7-4-11/h11-12,18-19H,1-10H2,(H,20,26)(H,21,22)(H,24,25)