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4-nitro-2-[(quinolin-2-ylcarbonylamino)methyl]phenolate

4-nitro-2-[(quinolin-2-ylcarbonylamino)methyl]phenolate

Systemtic Name:4-nitro-2-[(quinolin-2-ylcarbonylamino)methyl]phenolate
Openeye Name:4-nitro-2-[(quinoline-2-carbonylamino)methyl]phenolate
CAS Name:4-nitro-2-[[[oxo(2-quinolinyl)methyl]amino]methyl]phenolate
IUPAC Name:4-nitro-2-[(quinoline-2-carbonylamino)methyl]phenolate
Traditional Name:4-nitro-2-[(quinaldoylamino)methyl]phenolate
Formula: C17H12N3O4-
MolecularWeight: 322.29488
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=N2)C(=O)NCC3=C(C=CC(=C3)[N+](=O)[O-])[O-]


Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=N2)C(=O)NCC3=C(C=CC(=C3)[N+](=O)[O-])[O-]


InChI

InChI=1S/C17H13N3O4/c21-16-8-6-13(20(23)24)9-12(16)10-18-17(22)15-7-5-11-3-1-2-4-14(11)19-15/h1-9,21H,10H2,(H,18,22)/p-1


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