3-[[2,6-bis(bromanyl)-4-nitro-phenyl]diazenyl]-2-octadecoxy-naphthalen-1-ol

Systemtic Name: 3-[[2,6-bis(bromanyl)-4-nitro-phenyl]diazenyl]-2-octadecoxy-naphthalen-1-ol Openeye Name: 3-(2,6-dibromo-4-nitro-phenyl)azo-2-octadecoxy-naphthalen-1-ol CAS Name: 3-(2,6-dibromo-4-nitrophenyl)azo-2-octadecoxy-1-naphthalenol IUPAC Name: 3-[(2,6-dibromo-4-nitrophenyl)diazenyl]-2-octadecoxynaphthalen-1-ol Traditional Name: 3-(2,6-dibromo-4-nitro-phenyl)azo-2-stearyloxy-1-naphthol Formula: C34H45Br2N3O4 MolecularWeight: 719.5468

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC1=C(C2=CC=CC=C2C=C1N=NC3=C(C=C(C=C3Br)[N+](=O)[O-])Br)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC1=C(C2=CC=CC=C2C=C1N=NC3=C(C=C(C=C3Br)[N+](=O)[O-])Br)O

InChI

InChI=1S/C34H45Br2N3O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-22-43-34-31(23-26-20-17-18-21-28(26)33(34)40)37-38-32-29(35)24-27(39(41)42)25-30(32)36/h17-18,20-21,23-25,40H,2-16,19,22H2,1H3