3-[(4-bromanyl-3-nitro-phenyl)methylamino]-2,6-dimethyl-phenol

Systemtic Name: 3-[(4-bromanyl-3-nitro-phenyl)methylamino]-2,6-dimethyl-phenol Openeye Name: 3-[(4-bromo-3-nitro-phenyl)methylamino]-2,6-dimethyl-phenol CAS Name: 3-[(4-bromo-3-nitrophenyl)methylamino]-2,6-dimethylphenol IUPAC Name: 3-[(4-bromo-3-nitrophenyl)methylamino]-2,6-dimethylphenol Traditional Name: 3-[(4-bromo-3-nitro-benzyl)amino]-2,6-dimethyl-phenol Formula: C15H15BrN2O3 MolecularWeight: 351.1952

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)NCC2=CC(=C(C=C2)Br)[N+](=O)[O-])C)O

Isomeric SMILES

CC1=C(C(=C(C=C1)NCC2=CC(=C(C=C2)Br)[N+](=O)[O-])C)O

InChI

InChI=1S/C15H15BrN2O3/c1-9-3-6-13(10(2)15(9)19)17-8-11-4-5-12(16)14(7-11)18(20)21/h3-7,17,19H,8H2,1-2H3