3-nitro-N-[4-[2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethoxy]phenyl]benzamide

Systemtic Name: 3-nitro-N-[4-[2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethoxy]phenyl]benzamide Openeye Name: 3-nitro-N-[4-[2-oxo-2-(2-thienylmethylamino)ethoxy]phenyl]benzamide CAS Name: 3-nitro-N-[4-[2-oxo-2-(thiophen-2-ylmethylamino)ethoxy]phenyl]benzamide IUPAC Name: 3-nitro-N-[4-[2-oxo-2-(thiophen-2-ylmethylamino)ethoxy]phenyl]benzamide Traditional Name: N-[4-[2-keto-2-(2-thenylamino)ethoxy]phenyl]-3-nitro-benzamide Formula: C20H17N3O5S MolecularWeight: 411.43108

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)NC2=CC=C(C=C2)OCC(=O)NCC3=CC=CS3

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)NC2=CC=C(C=C2)OCC(=O)NCC3=CC=CS3

InChI

InChI=1S/C20H17N3O5S/c24-19(21-12-18-5-2-10-29-18)13-28-17-8-6-15(7-9-17)22-20(25)14-3-1-4-16(11-14)23(26)27/h1-11H,12-13H2,(H,21,24)(H,22,25)