[(2-methylpropan-2-yl)oxycarbonylamino] 8-(3-nitropyridin-2-yl)oxy-1,2,3,4-tetrahydronaphthalene-2-carboxylate

Systemtic Name: [(2-methylpropan-2-yl)oxycarbonylamino] 8-(3-nitropyridin-2-yl)oxy-1,2,3,4-tetrahydronaphthalene-2-carboxylate Openeye Name: (tert-butoxycarbonylamino) 8-[(3-nitro-2-pyridyl)oxy]tetralin-2-carboxylate CAS Name: 8-[(3-nitro-2-pyridinyl)oxy]-1,2,3,4-tetrahydronaphthalene-2-carboxylic acid [[(2-methylpropan-2-yl)oxy-oxomethyl]amino] ester IUPAC Name: [(2-methylpropan-2-yl)oxycarbonylamino] 8-(3-nitropyridin-2-yl)oxy-1,2,3,4-tetrahydronaphthalene-2-carboxylate Traditional Name: 8-[(3-nitro-2-pyridyl)oxy]tetralin-2-carboxylic acid (tert-butoxycarbonylamino) ester Formula: C21H23N3O7 MolecularWeight: 429.42322

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NOC(=O)C1CCC2=C(C1)C(=CC=C2)OC3=C(C=CC=N3)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)NOC(=O)C1CCC2=C(C1)C(=CC=C2)OC3=C(C=CC=N3)[N+](=O)[O-]

InChI

InChI=1S/C21H23N3O7/c1-21(2,3)30-20(26)23-31-19(25)14-10-9-13-6-4-8-17(15(13)12-14)29-18-16(24(27)28)7-5-11-22-18/h4-8,11,14H,9-10,12H2,1-3H3,(H,23,26)