4-[[4-[(2-methylpropan-2-yl)oxycarbonyl]-2-nitro-phenyl]amino]piperidine-1-carboxylic acid

Systemtic Name: 4-[[4-[(2-methylpropan-2-yl)oxycarbonyl]-2-nitro-phenyl]amino]piperidine-1-carboxylic acid Openeye Name: 4-(4-tert-butoxycarbonyl-2-nitro-anilino)piperidine-1-carboxylic acid CAS Name: 4-[4-[(2-methylpropan-2-yl)oxy-oxomethyl]-2-nitroanilino]-1-piperidinecarboxylic acid IUPAC Name: 4-[4-[(2-methylpropan-2-yl)oxycarbonyl]-2-nitroanilino]piperidine-1-carboxylic acid Traditional Name: 4-(4-tert-butoxycarbonyl-2-nitro-anilino)piperidine-1-carboxylic acid Formula: C17H23N3O6 MolecularWeight: 365.38102

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1=CC(=C(C=C1)NC2CCN(CC2)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)C1=CC(=C(C=C1)NC2CCN(CC2)C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C17H23N3O6/c1-17(2,3)26-15(21)11-4-5-13(14(10-11)20(24)25)18-12-6-8-19(9-7-12)16(22)23/h4-5,10,12,18H,6-9H2,1-3H3,(H,22,23)