(3S)-3-(4-tert-butylphenyl)-3-[(3-nitrophenyl)carbonylamino]propanoate

Systemtic Name: (3S)-3-(4-tert-butylphenyl)-3-[(3-nitrophenyl)carbonylamino]propanoate Openeye Name: (3S)-3-(4-tert-butylphenyl)-3-[(3-nitrobenzoyl)amino]propanoate CAS Name: (3S)-3-(4-tert-butylphenyl)-3-[[(3-nitrophenyl)-oxomethyl]amino]propanoate IUPAC Name: (3S)-3-(4-tert-butylphenyl)-3-[(3-nitrobenzoyl)amino]propanoate Traditional Name: (3S)-3-(4-tert-butylphenyl)-3-[(3-nitrobenzoyl)amino]propionate Formula: C20H21N2O5- MolecularWeight: 369.39114

Click to see the large picture

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@H](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)/p-1/t17-/m0/s1