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

Systemtic Name: 2-(1,3-benzoxazol-2-yl)-4-[(2-methyl-3-nitro-phenyl)carbonylamino]phenolate Openeye Name: 2-(1,3-benzoxazol-2-yl)-4-[(2-methyl-3-nitro-benzoyl)amino]phenolate CAS Name: 2-(1,3-benzoxazol-2-yl)-4-[[(2-methyl-3-nitrophenyl)-oxomethyl]amino]phenolate IUPAC Name: 2-(1,3-benzoxazol-2-yl)-4-[(2-methyl-3-nitrobenzoyl)amino]phenolate Traditional Name: 2-(1,3-benzoxazol-2-yl)-4-[(2-methyl-3-nitro-benzoyl)amino]phenolate Formula: C21H14N3O5- MolecularWeight: 388.35296

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)NC2=CC(=C(C=C2)[O-])C3=NC4=CC=CC=C4O3

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)NC2=CC(=C(C=C2)[O-])C3=NC4=CC=CC=C4O3

InChI

InChI=1S/C21H15N3O5/c1-12-14(5-4-7-17(12)24(27)28)20(26)22-13-9-10-18(25)15(11-13)21-23-16-6-2-3-8-19(16)29-21/h2-11,25H,1H3,(H,22,26)/p-1