7-[(S)-acetamido(thiophen-2-yl)methyl]-5-nitro-quinolin-8-olate

Systemtic Name: 7-[(S)-acetamido(thiophen-2-yl)methyl]-5-nitro-quinolin-8-olate Openeye Name: 7-[(S)-acetamido(2-thienyl)methyl]-5-nitro-quinolin-8-olate CAS Name: 7-[(S)-acetamido(thiophen-2-yl)methyl]-5-nitro-8-quinolinolate IUPAC Name: 7-[(S)-acetamido(thiophen-2-yl)methyl]-5-nitroquinolin-8-olate Traditional Name: 7-[(S)-acetamido(2-thienyl)methyl]-5-nitro-quinolin-8-olate Formula: C16H12N3O4S- MolecularWeight: 342.34918

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(C1=CC=CS1)C2=CC(=C3C=CC=NC3=C2[O-])[N+](=O)[O-]

Isomeric SMILES

CC(=O)N[C@H](C1=CC=CS1)C2=CC(=C3C=CC=NC3=C2[O-])[N+](=O)[O-]

InChI

InChI=1S/C16H13N3O4S/c1-9(20)18-14(13-5-3-7-24-13)11-8-12(19(22)23)10-4-2-6-17-15(10)16(11)21/h2-8,14,21H,1H3,(H,18,20)/p-1/t14-/m0/s1