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4-[[4-[dodecyl(methyl)amino]phenyl]diazenyl]-3-nitro-benzoic acid

4-[[4-[dodecyl(methyl)amino]phenyl]diazenyl]-3-nitro-benzoic acid

Systemtic Name:4-[[4-[dodecyl(methyl)amino]phenyl]diazenyl]-3-nitro-benzoic acid
Openeye Name:4-[4-[dodecyl(methyl)amino]phenyl]azo-3-nitro-benzoic acid
CAS Name:4-[4-[dodecyl(methyl)amino]phenyl]azo-3-nitrobenzoic acid
IUPAC Name:4-[[4-[dodecyl(methyl)amino]phenyl]diazenyl]-3-nitrobenzoic acid
Traditional Name:4-[4-[lauryl(methyl)amino]phenyl]azo-3-nitro-benzoic acid
Formula: C26H36N4O4
MolecularWeight: 468.58844
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCN(C)C1=CC=C(C=C1)N=NC2=C(C=C(C=C2)C(=O)O)[N+](=O)[O-]


Isomeric SMILES

CCCCCCCCCCCCN(C)C1=CC=C(C=C1)N=NC2=C(C=C(C=C2)C(=O)O)[N+](=O)[O-]


InChI

InChI=1S/C26H36N4O4/c1-3-4-5-6-7-8-9-10-11-12-19-29(2)23-16-14-22(15-17-23)27-28-24-18-13-21(26(31)32)20-25(24)30(33)34/h13-18,20H,3-12,19H2,1-2H3,(H,31,32)


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