4-bromanyl-2-[[(2-methoxy-5-nitro-phenyl)amino]methyl]phenol

Systemtic Name: 4-bromanyl-2-[[(2-methoxy-5-nitro-phenyl)amino]methyl]phenol Openeye Name: 4-bromo-2-[(2-methoxy-5-nitro-anilino)methyl]phenol CAS Name: 4-bromo-2-[(2-methoxy-5-nitroanilino)methyl]phenol IUPAC Name: 4-bromo-2-[(2-methoxy-5-nitroanilino)methyl]phenol Traditional Name: 4-bromo-2-[(2-methoxy-5-nitro-anilino)methyl]phenol Formula: C14H13BrN2O4 MolecularWeight: 353.16802

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])NCC2=C(C=CC(=C2)Br)O

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])NCC2=C(C=CC(=C2)Br)O

InChI

InChI=1S/C14H13BrN2O4/c1-21-14-5-3-11(17(19)20)7-12(14)16-8-9-6-10(15)2-4-13(9)18/h2-7,16,18H,8H2,1H3