2-[(2,4-dinitrophenyl)amino]-6-phenyl-hexanoic acid

Systemtic Name: 2-[(2,4-dinitrophenyl)amino]-6-phenyl-hexanoic acid Openeye Name: 2-(2,4-dinitroanilino)-6-phenyl-hexanoic acid CAS Name: 2-(2,4-dinitroanilino)-6-phenylhexanoic acid IUPAC Name: 2-(2,4-dinitroanilino)-6-phenylhexanoic acid Traditional Name: 2-(2,4-dinitroanilino)-6-phenyl-hexanoic acid Formula: C18H19N3O6 MolecularWeight: 373.35996

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19N3O6/c22-18(23)16(9-5-4-8-13-6-2-1-3-7-13)19-15-11-10-14(20(24)25)12-17(15)21(26)27/h1-3,6-7,10-12,16,19H,4-5,8-9H2,(H,22,23)