N-[2-(diethylamino)-2-thiophen-3-yl-ethyl]-3-nitro-benzamide

Systemtic Name: N-[2-(diethylamino)-2-thiophen-3-yl-ethyl]-3-nitro-benzamide Openeye Name: N-[2-(diethylamino)-2-(3-thienyl)ethyl]-3-nitro-benzamide CAS Name: N-[2-(diethylamino)-2-(3-thiophenyl)ethyl]-3-nitrobenzamide IUPAC Name: N-[2-(diethylamino)-2-thiophen-3-ylethyl]-3-nitrobenzamide Traditional Name: N-[2-(diethylamino)-2-(3-thienyl)ethyl]-3-nitro-benzamide Formula: C17H21N3O3S MolecularWeight: 347.43194

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(CNC(=O)C1=CC(=CC=C1)[N+](=O)[O-])C2=CSC=C2

Isomeric SMILES

CCN(CC)C(CNC(=O)C1=CC(=CC=C1)[N+](=O)[O-])C2=CSC=C2

InChI

InChI=1S/C17H21N3O3S/c1-3-19(4-2)16(14-8-9-24-12-14)11-18-17(21)13-6-5-7-15(10-13)20(22)23/h5-10,12,16H,3-4,11H2,1-2H3,(H,18,21)