N-[(1S)-1-(4-ethylphenyl)-2-methyl-propyl]-2-(4-methanoyl-2-nitro-phenoxy)ethanamide

Systemtic Name: N-[(1S)-1-(4-ethylphenyl)-2-methyl-propyl]-2-(4-methanoyl-2-nitro-phenoxy)ethanamide Openeye Name: N-[(1S)-1-(4-ethylphenyl)-2-methyl-propyl]-2-(4-formyl-2-nitro-phenoxy)acetamide CAS Name: N-[(1S)-1-(4-ethylphenyl)-2-methylpropyl]-2-(4-formyl-2-nitrophenoxy)acetamide IUPAC Name: N-[(1S)-1-(4-ethylphenyl)-2-methylpropyl]-2-(4-formyl-2-nitrophenoxy)acetamide Traditional Name: N-[(1S)-1-(4-ethylphenyl)-2-methyl-propyl]-2-(4-formyl-2-nitro-phenoxy)acetamide Formula: C21H24N2O5 MolecularWeight: 384.42566

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(C(C)C)NC(=O)COC2=C(C=C(C=C2)C=O)[N+](=O)[O-]

Isomeric SMILES

CCC1=CC=C(C=C1)[C@H](C(C)C)NC(=O)COC2=C(C=C(C=C2)C=O)[N+](=O)[O-]

InChI

InChI=1S/C21H24N2O5/c1-4-15-5-8-17(9-6-15)21(14(2)3)22-20(25)13-28-19-10-7-16(12-24)11-18(19)23(26)27/h5-12,14,21H,4,13H2,1-3H3,(H,22,25)/t21-/m0/s1