N-[(4E)-4-hydroxyimino-4-thiophen-2-yl-butyl]-3-methyl-4-nitro-benzamide

Systemtic Name: N-[(4E)-4-hydroxyimino-4-thiophen-2-yl-butyl]-3-methyl-4-nitro-benzamide Openeye Name: N-[(4E)-4-hydroxyimino-4-(2-thienyl)butyl]-3-methyl-4-nitro-benzamide CAS Name: N-[(4E)-4-hydroxyimino-4-thiophen-2-ylbutyl]-3-methyl-4-nitrobenzamide IUPAC Name: N-[(4E)-4-hydroxyimino-4-thiophen-2-ylbutyl]-3-methyl-4-nitrobenzamide Traditional Name: N-[(4E)-4-hydroximino-4-(2-thienyl)butyl]-3-methyl-4-nitro-benzamide Formula: C16H17N3O4S MolecularWeight: 347.38888

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)NCCCC(=NO)C2=CC=CS2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)NCCC/C(=N\O)/C2=CC=CS2)[N+](=O)[O-]

InChI

InChI=1S/C16H17N3O4S/c1-11-10-12(6-7-14(11)19(22)23)16(20)17-8-2-4-13(18-21)15-5-3-9-24-15/h3,5-7,9-10,21H,2,4,8H2,1H3,(H,17,20)/b18-13+