2-[[(2-methyl-4-phenyl-1,3-thiazol-5-yl)carbonylamino]methyl]-4-nitro-phenolate

Systemtic Name: 2-[[(2-methyl-4-phenyl-1,3-thiazol-5-yl)carbonylamino]methyl]-4-nitro-phenolate Openeye Name: 2-[[(2-methyl-4-phenyl-thiazole-5-carbonyl)amino]methyl]-4-nitro-phenolate CAS Name: 2-[[[(2-methyl-4-phenyl-5-thiazolyl)-oxomethyl]amino]methyl]-4-nitrophenolate IUPAC Name: 2-[[(2-methyl-4-phenyl-1,3-thiazole-5-carbonyl)amino]methyl]-4-nitrophenolate Traditional Name: 2-[[(2-methyl-4-phenyl-thiazole-5-carbonyl)amino]methyl]-4-nitro-phenolate Formula: C18H14N3O4S- MolecularWeight: 368.38646

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(S1)C(=O)NCC2=C(C=CC(=C2)[N+](=O)[O-])[O-])C3=CC=CC=C3

Isomeric SMILES

CC1=NC(=C(S1)C(=O)NCC2=C(C=CC(=C2)[N+](=O)[O-])[O-])C3=CC=CC=C3

InChI

InChI=1S/C18H15N3O4S/c1-11-20-16(12-5-3-2-4-6-12)17(26-11)18(23)19-10-13-9-14(21(24)25)7-8-15(13)22/h2-9,22H,10H2,1H3,(H,19,23)/p-1