5-methoxy-4-(2-methoxyethoxy)-N-(2-morpholin-4-yl-2-thiophen-2-yl-ethyl)-2-nitro-benzamide

Systemtic Name: 5-methoxy-4-(2-methoxyethoxy)-N-(2-morpholin-4-yl-2-thiophen-2-yl-ethyl)-2-nitro-benzamide Openeye Name: 5-methoxy-4-(2-methoxyethoxy)-N-[2-morpholino-2-(2-thienyl)ethyl]-2-nitro-benzamide CAS Name: 5-methoxy-4-(2-methoxyethoxy)-N-[2-(4-morpholinyl)-2-thiophen-2-ylethyl]-2-nitrobenzamide IUPAC Name: 5-methoxy-4-(2-methoxyethoxy)-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)-2-nitrobenzamide Traditional Name: 5-methoxy-4-(2-methoxyethoxy)-N-[2-morpholino-2-(2-thienyl)ethyl]-2-nitro-benzamide Formula: C21H27N3O7S MolecularWeight: 465.51998

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Descriptors Computed from Structure

Canonical SMILES:

COCCOC1=C(C=C(C(=C1)[N+](=O)[O-])C(=O)NCC(C2=CC=CS2)N3CCOCC3)OC

Isomeric SMILES

COCCOC1=C(C=C(C(=C1)[N+](=O)[O-])C(=O)NCC(C2=CC=CS2)N3CCOCC3)OC

InChI

InChI=1S/C21H27N3O7S/c1-28-9-10-31-19-13-16(24(26)27)15(12-18(19)29-2)21(25)22-14-17(20-4-3-11-32-20)23-5-7-30-8-6-23/h3-4,11-13,17H,5-10,14H2,1-2H3,(H,22,25)