2-[14-methylpentadecanoyl-(4-nitrophenyl)amino]ethanoic acid

Systemtic Name: 2-[14-methylpentadecanoyl-(4-nitrophenyl)amino]ethanoic acid Openeye Name: 2-[N-(14-methylpentadecanoyl)-4-nitro-anilino]acetic acid CAS Name: 2-(N-(14-methyl-1-oxopentadecyl)-4-nitroanilino)acetic acid IUPAC Name: 2-[N-(14-methylpentadecanoyl)-4-nitroanilino]acetic acid Traditional Name: 2-[N-(14-methylpentadecanoyl)-4-nitro-anilino]acetic acid Formula: C24H38N2O5 MolecularWeight: 434.56892

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCCCCCCCCCC(=O)N(CC(=O)O)C1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

CC(C)CCCCCCCCCCCCC(=O)N(CC(=O)O)C1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C24H38N2O5/c1-20(2)13-11-9-7-5-3-4-6-8-10-12-14-23(27)25(19-24(28)29)21-15-17-22(18-16-21)26(30)31/h15-18,20H,3-14,19H2,1-2H3,(H,28,29)