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6-[3-(naphthalen-2-ylamino)-4-nitro-phenoxy]hexanoic acid

6-[3-(naphthalen-2-ylamino)-4-nitro-phenoxy]hexanoic acid

Systemtic Name:6-[3-(naphthalen-2-ylamino)-4-nitro-phenoxy]hexanoic acid
Openeye Name:6-[3-(2-naphthylamino)-4-nitro-phenoxy]hexanoic acid
CAS Name:6-[3-(2-naphthalenylamino)-4-nitrophenoxy]hexanoic acid
IUPAC Name:6-[3-(naphthalen-2-ylamino)-4-nitrophenoxy]hexanoic acid
Traditional Name:6-[3-(2-naphthylamino)-4-nitro-phenoxy]hexanoic acid
Formula: C22H22N2O5
MolecularWeight: 394.42048
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)NC3=C(C=CC(=C3)OCCCCCC(=O)O)[N+](=O)[O-]


Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)NC3=C(C=CC(=C3)OCCCCCC(=O)O)[N+](=O)[O-]


InChI

InChI=1S/C22H22N2O5/c25-22(26)8-2-1-5-13-29-19-11-12-21(24(27)28)20(15-19)23-18-10-9-16-6-3-4-7-17(16)14-18/h3-4,6-7,9-12,14-15,23H,1-2,5,8,13H2,(H,25,26)


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