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

Systemtic Name: 7-[(R)-acetamido-(4-propan-2-ylphenyl)methyl]-5-nitro-quinolin-8-olate Openeye Name: 7-[(R)-acetamido-(4-isopropylphenyl)methyl]-5-nitro-quinolin-8-olate CAS Name: 7-[(R)-acetamido-(4-propan-2-ylphenyl)methyl]-5-nitro-8-quinolinolate IUPAC Name: 7-[(R)-acetamido-(4-propan-2-ylphenyl)methyl]-5-nitroquinolin-8-olate Traditional Name: 7-[(R)-acetamido(p-cumenyl)methyl]-5-nitro-quinolin-8-olate Formula: C21H20N3O4- MolecularWeight: 378.4012

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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)C

Isomeric SMILES

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

InChI

InChI=1S/C21H21N3O4/c1-12(2)14-6-8-15(9-7-14)19(23-13(3)25)17-11-18(24(27)28)16-5-4-10-22-20(16)21(17)26/h4-12,19,26H,1-3H3,(H,23,25)/p-1/t19-/m1/s1