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6-[3-[(4-methylphenyl)amino]-4-nitro-phenoxy]hexanoic acid

6-[3-[(4-methylphenyl)amino]-4-nitro-phenoxy]hexanoic acid

Systemtic Name:6-[3-[(4-methylphenyl)amino]-4-nitro-phenoxy]hexanoic acid
Openeye Name:6-[3-(4-methylanilino)-4-nitro-phenoxy]hexanoic acid
CAS Name:6-[3-(4-methylanilino)-4-nitrophenoxy]hexanoic acid
IUPAC Name:6-[3-(4-methylanilino)-4-nitrophenoxy]hexanoic acid
Traditional Name:6-[4-nitro-3-(p-toluidino)phenoxy]hexanoic acid
Formula: C19H22N2O5
MolecularWeight: 358.38838
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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=C(C=CC(=C2)OCCCCCC(=O)O)[N+](=O)[O-]


Isomeric SMILES

CC1=CC=C(C=C1)NC2=C(C=CC(=C2)OCCCCCC(=O)O)[N+](=O)[O-]


InChI

InChI=1S/C19H22N2O5/c1-14-6-8-15(9-7-14)20-17-13-16(10-11-18(17)21(24)25)26-12-4-2-3-5-19(22)23/h6-11,13,20H,2-5,12H2,1H3,(H,22,23)


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