4-chloranyl-N-(2-morpholin-4-yl-2-thiophen-3-yl-ethyl)-3-nitro-benzamide

Systemtic Name: 4-chloranyl-N-(2-morpholin-4-yl-2-thiophen-3-yl-ethyl)-3-nitro-benzamide Openeye Name: 4-chloro-N-[2-morpholino-2-(3-thienyl)ethyl]-3-nitro-benzamide CAS Name: 4-chloro-N-[2-(4-morpholinyl)-2-(3-thiophenyl)ethyl]-3-nitrobenzamide IUPAC Name: 4-chloro-N-(2-morpholin-4-yl-2-thiophen-3-ylethyl)-3-nitrobenzamide Traditional Name: 4-chloro-N-[2-morpholino-2-(3-thienyl)ethyl]-3-nitro-benzamide Formula: C17H18ClN3O4S MolecularWeight: 395.86052

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(CNC(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-])C3=CSC=C3

Isomeric SMILES

C1COCCN1C(CNC(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-])C3=CSC=C3

InChI

InChI=1S/C17H18ClN3O4S/c18-14-2-1-12(9-15(14)21(23)24)17(22)19-10-16(13-3-8-26-11-13)20-4-6-25-7-5-20/h1-3,8-9,11,16H,4-7,10H2,(H,19,22)