2-[(R)-benzotriazol-1-yl-[(3-hydroxyphenyl)amino]methyl]-4-nitro-phenolate

Systemtic Name: 2-[(R)-benzotriazol-1-yl-[(3-hydroxyphenyl)amino]methyl]-4-nitro-phenolate Openeye Name: 2-[(R)-benzotriazol-1-yl-(3-hydroxyanilino)methyl]-4-nitro-phenolate CAS Name: 2-[(R)-1-benzotriazolyl-(3-hydroxyanilino)methyl]-4-nitrophenolate IUPAC Name: 2-[(R)-benzotriazol-1-yl-(3-hydroxyanilino)methyl]-4-nitrophenolate Traditional Name: 2-[(R)-benzotriazol-1-yl-(3-hydroxyanilino)methyl]-4-nitro-phenolate Formula: C19H14N5O4- MolecularWeight: 376.34556

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=NN2C(C3=C(C=CC(=C3)[N+](=O)[O-])[O-])NC4=CC(=CC=C4)O

Isomeric SMILES

C1=CC=C2C(=C1)N=NN2[C@H](C3=C(C=CC(=C3)[N+](=O)[O-])[O-])NC4=CC(=CC=C4)O

InChI

InChI=1S/C19H15N5O4/c25-14-5-3-4-12(10-14)20-19(15-11-13(24(27)28)8-9-18(15)26)23-17-7-2-1-6-16(17)21-22-23/h1-11,19-20,25-26H/p-1/t19-/m1/s1