5-[[3-[(3-nitrophenyl)carbamoyl]thiophen-2-yl]amino]-5-oxidanylidene-pentanoate

Systemtic Name: 5-[[3-[(3-nitrophenyl)carbamoyl]thiophen-2-yl]amino]-5-oxidanylidene-pentanoate Openeye Name: 5-[[3-[(3-nitrophenyl)carbamoyl]-2-thienyl]amino]-5-oxo-pentanoate CAS Name: 5-[[3-[(3-nitroanilino)-oxomethyl]-2-thiophenyl]amino]-5-oxopentanoate IUPAC Name: 5-[[3-[(3-nitrophenyl)carbamoyl]thiophen-2-yl]amino]-5-oxopentanoate Traditional Name: 5-keto-5-[[3-[(3-nitrophenyl)carbamoyl]-2-thienyl]amino]valerate Formula: C16H14N3O6S- MolecularWeight: 376.36386

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H15N3O6S/c20-13(5-2-6-14(21)22)18-16-12(7-8-26-16)15(23)17-10-3-1-4-11(9-10)19(24)25/h1,3-4,7-9H,2,5-6H2,(H,17,23)(H,18,20)(H,21,22)/p-1