4-[4-[(2-methylpropan-2-yl)oxycarbonylamino]-3-nitro-phenyl]-3,6-dihydro-2H-pyridine-1-carboxylic acid

Systemtic Name: 4-[4-[(2-methylpropan-2-yl)oxycarbonylamino]-3-nitro-phenyl]-3,6-dihydro-2H-pyridine-1-carboxylic acid Openeye Name: 4-[4-(tert-butoxycarbonylamino)-3-nitro-phenyl]-3,6-dihydro-2H-pyridine-1-carboxylic acid CAS Name: 4-[4-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-nitrophenyl]-3,6-dihydro-2H-pyridine-1-carboxylic acid IUPAC Name: 4-[4-[(2-methylpropan-2-yl)oxycarbonylamino]-3-nitrophenyl]-3,6-dihydro-2H-pyridine-1-carboxylic acid Traditional Name: 4-[4-(tert-butoxycarbonylamino)-3-nitro-phenyl]-3,6-dihydro-2H-pyridine-1-carboxylic acid Formula: C17H21N3O6 MolecularWeight: 363.36514

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1=C(C=C(C=C1)C2=CCN(CC2)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)NC1=C(C=C(C=C1)C2=CCN(CC2)C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C17H21N3O6/c1-17(2,3)26-15(21)18-13-5-4-12(10-14(13)20(24)25)11-6-8-19(9-7-11)16(22)23/h4-6,10H,7-9H2,1-3H3,(H,18,21)(H,22,23)