2-nitro-4-[(4R)-2,7,7-trimethyl-5-oxidanylidene-3-phenylmethoxycarbonyl-1,4,6,8-tetrahydroquinolin-4-yl]phenolate

Systemtic Name: 2-nitro-4-[(4R)-2,7,7-trimethyl-5-oxidanylidene-3-phenylmethoxycarbonyl-1,4,6,8-tetrahydroquinolin-4-yl]phenolate Openeye Name: 4-[(4R)-3-benzyloxycarbonyl-2,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydroquinolin-4-yl]-2-nitro-phenolate CAS Name: 2-nitro-4-[(4R)-2,7,7-trimethyl-5-oxo-3-phenylmethoxycarbonyl-1,4,6,8-tetrahydroquinolin-4-yl]phenolate IUPAC Name: 2-nitro-4-[(4R)-2,7,7-trimethyl-5-oxo-3-phenylmethoxycarbonyl-1,4,6,8-tetrahydroquinolin-4-yl]phenolate Traditional Name: 4-[(4R)-3-carbobenzoxy-5-keto-2,7,7-trimethyl-1,4,6,8-tetrahydroquinolin-4-yl]-2-nitro-phenolate Formula: C26H25N2O6- MolecularWeight: 461.4865

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C2=C(N1)CC(CC2=O)(C)C)C3=CC(=C(C=C3)[O-])[N+](=O)[O-])C(=O)OCC4=CC=CC=C4

Isomeric SMILES

CC1=C([C@@H](C2=C(N1)CC(CC2=O)(C)C)C3=CC(=C(C=C3)[O-])[N+](=O)[O-])C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C26H26N2O6/c1-15-22(25(31)34-14-16-7-5-4-6-8-16)23(17-9-10-20(29)19(11-17)28(32)33)24-18(27-15)12-26(2,3)13-21(24)30/h4-11,23,27,29H,12-14H2,1-3H3/p-1/t23-/m0/s1