4-chloranyl-N-[2-(dimethylamino)-2-thiophen-3-yl-ethyl]-3-nitro-benzamide

Systemtic Name: 4-chloranyl-N-[2-(dimethylamino)-2-thiophen-3-yl-ethyl]-3-nitro-benzamide Openeye Name: 4-chloro-N-[2-(dimethylamino)-2-(3-thienyl)ethyl]-3-nitro-benzamide CAS Name: 4-chloro-N-[2-(dimethylamino)-2-(3-thiophenyl)ethyl]-3-nitrobenzamide IUPAC Name: 4-chloro-N-[2-(dimethylamino)-2-thiophen-3-ylethyl]-3-nitrobenzamide Traditional Name: 4-chloro-N-[2-(dimethylamino)-2-(3-thienyl)ethyl]-3-nitro-benzamide Formula: C15H16ClN3O3S MolecularWeight: 353.82384

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H16ClN3O3S/c1-18(2)14(11-5-6-23-9-11)8-17-15(20)10-3-4-12(16)13(7-10)19(21)22/h3-7,9,14H,8H2,1-2H3,(H,17,20)