2-[[4-[(2S)-butan-2-yl]phenyl]sulfonylamino]-4-nitro-phenolate

Systemtic Name: 2-[[4-[(2S)-butan-2-yl]phenyl]sulfonylamino]-4-nitro-phenolate Openeye Name: 2-[[4-[(1S)-1-methylpropyl]phenyl]sulfonylamino]-4-nitro-phenolate CAS Name: 2-[[4-[(2S)-butan-2-yl]phenyl]sulfonylamino]-4-nitrophenolate IUPAC Name: 2-[[4-[(2S)-butan-2-yl]phenyl]sulfonylamino]-4-nitrophenolate Traditional Name: 2-[[4-[(1S)-1-methylpropyl]phenyl]sulfonylamino]-4-nitro-phenolate Formula: C16H17N2O5S- MolecularWeight: 349.38158

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)S(=O)(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])[O-]

Isomeric SMILES

CC[C@H](C)C1=CC=C(C=C1)S(=O)(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])[O-]

InChI

InChI=1S/C16H18N2O5S/c1-3-11(2)12-4-7-14(8-5-12)24(22,23)17-15-10-13(18(20)21)6-9-16(15)19/h4-11,17,19H,3H2,1-2H3/p-1/t11-/m0/s1