3-(4-tert-butylphenyl)-3-[(3-nitrophenyl)carbonylamino]propanoic acid

Systemtic Name: 3-(4-tert-butylphenyl)-3-[(3-nitrophenyl)carbonylamino]propanoic acid Openeye Name: 3-(4-tert-butylphenyl)-3-[(3-nitrobenzoyl)amino]propanoic acid CAS Name: 3-(4-tert-butylphenyl)-3-[[(3-nitrophenyl)-oxomethyl]amino]propanoic acid IUPAC Name: 3-(4-tert-butylphenyl)-3-[(3-nitrobenzoyl)amino]propanoic acid Traditional Name: 3-(4-tert-butylphenyl)-3-[(3-nitrobenzoyl)amino]propionic acid Formula: C20H22N2O5 MolecularWeight: 370.39908

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22N2O5/c1-20(2,3)15-9-7-13(8-10-15)17(12-18(23)24)21-19(25)14-5-4-6-16(11-14)22(26)27/h4-11,17H,12H2,1-3H3,(H,21,25)(H,23,24)