7-[(R)-(cyclohexylcarbonylamino)-(4-propan-2-ylphenyl)methyl]-5-nitro-quinolin-8-olate

Systemtic Name: 7-[(R)-(cyclohexylcarbonylamino)-(4-propan-2-ylphenyl)methyl]-5-nitro-quinolin-8-olate Openeye Name: 7-[(R)-(cyclohexanecarbonylamino)-(4-isopropylphenyl)methyl]-5-nitro-quinolin-8-olate CAS Name: 7-[(R)-[[cyclohexyl(oxo)methyl]amino]-(4-propan-2-ylphenyl)methyl]-5-nitro-8-quinolinolate IUPAC Name: 7-[(R)-(cyclohexanecarbonylamino)-(4-propan-2-ylphenyl)methyl]-5-nitroquinolin-8-olate Traditional Name: 7-[(R)-(cyclohexanecarbonylamino)-p-cumenyl-methyl]-5-nitro-quinolin-8-olate Formula: C26H28N3O4- MolecularWeight: 446.51822

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C(C2=CC(=C3C=CC=NC3=C2[O-])[N+](=O)[O-])NC(=O)C4CCCCC4

Isomeric SMILES

CC(C)C1=CC=C(C=C1)[C@H](C2=CC(=C3C=CC=NC3=C2[O-])[N+](=O)[O-])NC(=O)C4CCCCC4

InChI

InChI=1S/C26H29N3O4/c1-16(2)17-10-12-18(13-11-17)23(28-26(31)19-7-4-3-5-8-19)21-15-22(29(32)33)20-9-6-14-27-24(20)25(21)30/h6,9-16,19,23,30H,3-5,7-8H2,1-2H3,(H,28,31)/p-1/t23-/m1/s1