5-[[1,3-bis(oxidanylidene)isoindol-2-yl]methyl]-2-ethoxy-N-[(4E)-4-hydroxyimino-4-thiophen-2-yl-butyl]benzamide

Systemtic Name: 5-[[1,3-bis(oxidanylidene)isoindol-2-yl]methyl]-2-ethoxy-N-[(4E)-4-hydroxyimino-4-thiophen-2-yl-butyl]benzamide Openeye Name: 5-[(1,3-dioxoisoindolin-2-yl)methyl]-2-ethoxy-N-[(4E)-4-hydroxyimino-4-(2-thienyl)butyl]benzamide CAS Name: 5-[(1,3-dioxo-2-isoindolyl)methyl]-2-ethoxy-N-[(4E)-4-hydroxyimino-4-thiophen-2-ylbutyl]benzamide IUPAC Name: 5-[(1,3-dioxoisoindol-2-yl)methyl]-2-ethoxy-N-[(4E)-4-hydroxyimino-4-thiophen-2-ylbutyl]benzamide Traditional Name: 2-ethoxy-N-[(4E)-4-hydroximino-4-(2-thienyl)butyl]-5-(phthalimidomethyl)benzamide Formula: C26H25N3O5S MolecularWeight: 491.5588

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CN2C(=O)C3=CC=CC=C3C2=O)C(=O)NCCCC(=NO)C4=CC=CS4

Isomeric SMILES

CCOC1=C(C=C(C=C1)CN2C(=O)C3=CC=CC=C3C2=O)C(=O)NCCC/C(=N\O)/C4=CC=CS4

InChI

InChI=1S/C26H25N3O5S/c1-2-34-22-12-11-17(16-29-25(31)18-7-3-4-8-19(18)26(29)32)15-20(22)24(30)27-13-5-9-21(28-33)23-10-6-14-35-23/h3-4,6-8,10-12,14-15,33H,2,5,9,13,16H2,1H3,(H,27,30)/b28-21+