1-[[4-[(2-bromanyl-4,6-dinitro-phenyl)diazenyl]naphthalen-1-yl]amino]-3-butoxy-propan-2-ol

Systemtic Name: 1-[[4-[(2-bromanyl-4,6-dinitro-phenyl)diazenyl]naphthalen-1-yl]amino]-3-butoxy-propan-2-ol Openeye Name: 1-[[4-(2-bromo-4,6-dinitro-phenyl)azo-1-naphthyl]amino]-3-butoxy-propan-2-ol CAS Name: 1-[[4-(2-bromo-4,6-dinitrophenyl)azo-1-naphthalenyl]amino]-3-butoxy-2-propanol IUPAC Name: 1-[[4-[(2-bromo-4,6-dinitrophenyl)diazenyl]naphthalen-1-yl]amino]-3-butoxypropan-2-ol Traditional Name: 1-[[4-(2-bromo-4,6-dinitro-phenyl)azo-1-naphthyl]amino]-3-butoxy-propan-2-ol Formula: C23H24BrN5O6 MolecularWeight: 546.37056

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOCC(CNC1=CC=C(C2=CC=CC=C21)N=NC3=C(C=C(C=C3Br)[N+](=O)[O-])[N+](=O)[O-])O

Isomeric SMILES

CCCCOCC(CNC1=CC=C(C2=CC=CC=C21)N=NC3=C(C=C(C=C3Br)[N+](=O)[O-])[N+](=O)[O-])O

InChI

InChI=1S/C23H24BrN5O6/c1-2-3-10-35-14-16(30)13-25-20-8-9-21(18-7-5-4-6-17(18)20)26-27-23-19(24)11-15(28(31)32)12-22(23)29(33)34/h4-9,11-12,16,25,30H,2-3,10,13-14H2,1H3