2-methoxyethyl 3-butyl-6-methyl-4-(3-nitrophenyl)-4,7-dihydrothieno[2,3-b]pyridine-5-carboxylate

Systemtic Name: 2-methoxyethyl 3-butyl-6-methyl-4-(3-nitrophenyl)-4,7-dihydrothieno[2,3-b]pyridine-5-carboxylate Openeye Name: 2-methoxyethyl 3-butyl-6-methyl-4-(3-nitrophenyl)-4,7-dihydrothieno[2,3-b]pyridine-5-carboxylate CAS Name: 3-butyl-6-methyl-4-(3-nitrophenyl)-4,7-dihydrothieno[2,3-b]pyridine-5-carboxylic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl 3-butyl-6-methyl-4-(3-nitrophenyl)-4,7-dihydrothieno[2,3-b]pyridine-5-carboxylate Traditional Name: 3-butyl-6-methyl-4-(3-nitrophenyl)-4,7-dihydrothieno[2,3-b]pyridine-5-carboxylic acid 2-methoxyethyl ester Formula: C22H26N2O5S MolecularWeight: 430.51724

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CSC2=C1C(C(=C(N2)C)C(=O)OCCOC)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CCCCC1=CSC2=C1C(C(=C(N2)C)C(=O)OCCOC)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H26N2O5S/c1-4-5-7-16-13-30-21-20(16)19(15-8-6-9-17(12-15)24(26)27)18(14(2)23-21)22(25)29-11-10-28-3/h6,8-9,12-13,19,23H,4-5,7,10-11H2,1-3H3