2-chloranyl-N-[(4-ethylphenyl)-thiophen-2-yl-methyl]-4-nitro-benzamide

Systemtic Name: 2-chloranyl-N-[(4-ethylphenyl)-thiophen-2-yl-methyl]-4-nitro-benzamide Openeye Name: 2-chloro-N-[(4-ethylphenyl)-(2-thienyl)methyl]-4-nitro-benzamide CAS Name: 2-chloro-N-[(4-ethylphenyl)-thiophen-2-ylmethyl]-4-nitrobenzamide IUPAC Name: 2-chloro-N-[(4-ethylphenyl)-thiophen-2-ylmethyl]-4-nitrobenzamide Traditional Name: 2-chloro-N-[(4-ethylphenyl)-(2-thienyl)methyl]-4-nitro-benzamide Formula: C20H17ClN2O3S MolecularWeight: 400.87858

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(C2=CC=CS2)NC(=O)C3=C(C=C(C=C3)[N+](=O)[O-])Cl

Isomeric SMILES

CCC1=CC=C(C=C1)C(C2=CC=CS2)NC(=O)C3=C(C=C(C=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C20H17ClN2O3S/c1-2-13-5-7-14(8-6-13)19(18-4-3-11-27-18)22-20(24)16-10-9-15(23(25)26)12-17(16)21/h3-12,19H,2H2,1H3,(H,22,24)