ethyl 3-[(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)carbonyl]-5-nitro-benzoate

Systemtic Name: ethyl 3-[(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)carbonyl]-5-nitro-benzoate Openeye Name: ethyl 3-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carbonyl)-5-nitro-benzoate CAS Name: 3-[(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-oxomethyl]-5-nitrobenzoic acid ethyl ester IUPAC Name: ethyl 3-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carbonyl)-5-nitrobenzoate Traditional Name: 3-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carbonyl)-5-nitro-benzoic acid ethyl ester Formula: C18H18N2O5S MolecularWeight: 374.41092

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1)C(=O)N2CCC3=C(C2C)C=CS3)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)C(=O)N2CCC3=C(C2C)C=CS3)[N+](=O)[O-]

InChI

InChI=1S/C18H18N2O5S/c1-3-25-18(22)13-8-12(9-14(10-13)20(23)24)17(21)19-6-4-16-15(11(19)2)5-7-26-16/h5,7-11H,3-4,6H2,1-2H3