(3S)-3-(2-chloranyl-5-nitro-phenyl)-3-(2-thiophen-2-ylethanoylamino)propanoate

Systemtic Name: (3S)-3-(2-chloranyl-5-nitro-phenyl)-3-(2-thiophen-2-ylethanoylamino)propanoate Openeye Name: (3S)-3-(2-chloro-5-nitro-phenyl)-3-[[2-(2-thienyl)acetyl]amino]propanoate CAS Name: (3S)-3-(2-chloro-5-nitrophenyl)-3-[(1-oxo-2-thiophen-2-ylethyl)amino]propanoate IUPAC Name: (3S)-3-(2-chloro-5-nitrophenyl)-3-[(2-thiophen-2-ylacetyl)amino]propanoate Traditional Name: (3S)-3-(2-chloro-5-nitro-phenyl)-3-[[2-(2-thienyl)acetyl]amino]propionate Formula: C15H12ClN2O5S- MolecularWeight: 367.78418

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C1=CSC(=C1)CC(=O)N[C@@H](CC(=O)[O-])C2=C(C=CC(=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C15H13ClN2O5S/c16-12-4-3-9(18(22)23)6-11(12)13(8-15(20)21)17-14(19)7-10-2-1-5-24-10/h1-6,13H,7-8H2,(H,17,19)(H,20,21)/p-1/t13-/m0/s1