(2R)-2-[(3,5-dimethyl-4-nitro-phenyl)carbonylamino]-3-phenyl-propanoate

Systemtic Name: (2R)-2-[(3,5-dimethyl-4-nitro-phenyl)carbonylamino]-3-phenyl-propanoate Openeye Name: (2R)-2-[(3,5-dimethyl-4-nitro-benzoyl)amino]-3-phenyl-propanoate CAS Name: (2R)-2-[[(3,5-dimethyl-4-nitrophenyl)-oxomethyl]amino]-3-phenylpropanoate IUPAC Name: (2R)-2-[(3,5-dimethyl-4-nitrobenzoyl)amino]-3-phenylpropanoate Traditional Name: (2R)-2-[(3,5-dimethyl-4-nitro-benzoyl)amino]-3-phenyl-propionate Formula: C18H17N2O5- MolecularWeight: 341.33798

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1[N+](=O)[O-])C)C(=O)NC(CC2=CC=CC=C2)C(=O)[O-]

Isomeric SMILES

CC1=CC(=CC(=C1[N+](=O)[O-])C)C(=O)N[C@H](CC2=CC=CC=C2)C(=O)[O-]

InChI

InChI=1S/C18H18N2O5/c1-11-8-14(9-12(2)16(11)20(24)25)17(21)19-15(18(22)23)10-13-6-4-3-5-7-13/h3-9,15H,10H2,1-2H3,(H,19,21)(H,22,23)/p-1/t15-/m1/s1