ethyl 7,9-dimethyl-2-(2-nitrophenyl)-1-oxidanylidene-thieno[3,2-a]indolizine-4-carboxylate

Systemtic Name: ethyl 7,9-dimethyl-2-(2-nitrophenyl)-1-oxidanylidene-thieno[3,2-a]indolizine-4-carboxylate Openeye Name: ethyl 7,9-dimethyl-2-(2-nitrophenyl)-1-oxo-thieno[3,2-a]indolizine-4-carboxylate CAS Name: 7,9-dimethyl-2-(2-nitrophenyl)-1-oxo-4-thieno[3,2-a]indolizinecarboxylic acid ethyl ester IUPAC Name: ethyl 7,9-dimethyl-2-(2-nitrophenyl)-1-oxothieno[3,2-a]indolizine-4-carboxylate Traditional Name: 1-keto-7,9-dimethyl-2-(2-nitrophenyl)thien[3,2-a]indolizine-4-carboxylic acid ethyl ester Formula: C21H18N2O5S MolecularWeight: 410.44302

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C2C(=C3N1C=C(C=C3C)C)C(=O)C(S2)C4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=C2C(=C3N1C=C(C=C3C)C)C(=O)C(S2)C4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C21H18N2O5S/c1-4-28-21(25)17-20-15(16-12(3)9-11(2)10-22(16)17)18(24)19(29-20)13-7-5-6-8-14(13)23(26)27/h5-10,19H,4H2,1-3H3