N-(3-morpholin-4-ylcarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(2-nitrophenoxy)ethanamide

Systemtic Name: N-(3-morpholin-4-ylcarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(2-nitrophenoxy)ethanamide Openeye Name: N-[3-(morpholine-4-carbonyl)-4,5,6,7-tetrahydrobenzothiophen-2-yl]-2-(2-nitrophenoxy)acetamide CAS Name: N-[3-[4-morpholinyl(oxo)methyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-(2-nitrophenoxy)acetamide IUPAC Name: N-[3-(morpholine-4-carbonyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-(2-nitrophenoxy)acetamide Traditional Name: N-[3-(morpholine-4-carbonyl)-4,5,6,7-tetrahydrobenzothiophen-2-yl]-2-(2-nitrophenoxy)acetamide Formula: C21H23N3O6S MolecularWeight: 445.48882

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=C(S2)NC(=O)COC3=CC=CC=C3[N+](=O)[O-])C(=O)N4CCOCC4

Isomeric SMILES

C1CCC2=C(C1)C(=C(S2)NC(=O)COC3=CC=CC=C3[N+](=O)[O-])C(=O)N4CCOCC4

InChI

InChI=1S/C21H23N3O6S/c25-18(13-30-16-7-3-2-6-15(16)24(27)28)22-20-19(14-5-1-4-8-17(14)31-20)21(26)23-9-11-29-12-10-23/h2-3,6-7H,1,4-5,8-13H2,(H,22,25)