methyl 2-(2-nitro-1-thiophen-2-yl-ethyl)-3-oxidanylidene-1H-indene-2-carboxylate

Systemtic Name: methyl 2-(2-nitro-1-thiophen-2-yl-ethyl)-3-oxidanylidene-1H-indene-2-carboxylate Openeye Name: methyl 2-[2-nitro-1-(2-thienyl)ethyl]-1-oxo-indane-2-carboxylate CAS Name: 2-(2-nitro-1-thiophen-2-ylethyl)-3-oxo-1H-indene-2-carboxylic acid methyl ester IUPAC Name: methyl 2-(2-nitro-1-thiophen-2-ylethyl)-3-oxo-1H-indene-2-carboxylate Traditional Name: 1-keto-2-[2-nitro-1-(2-thienyl)ethyl]indane-2-carboxylic acid methyl ester Formula: C17H15NO5S MolecularWeight: 345.3697

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1(CC2=CC=CC=C2C1=O)C(C[N+](=O)[O-])C3=CC=CS3

Isomeric SMILES

COC(=O)C1(CC2=CC=CC=C2C1=O)C(C[N+](=O)[O-])C3=CC=CS3

InChI

InChI=1S/C17H15NO5S/c1-23-16(20)17(9-11-5-2-3-6-12(11)15(17)19)13(10-18(21)22)14-7-4-8-24-14/h2-8,13H,9-10H2,1H3