1-[(2-chlorophenyl)methyl]-3-[(E)-C-methyl-N-oxidanyl-carbonimidoyl]-2-propyl-indole-6-carboxamide

Systemtic Name: 1-[(2-chlorophenyl)methyl]-3-[(E)-C-methyl-N-oxidanyl-carbonimidoyl]-2-propyl-indole-6-carboxamide Openeye Name: 1-[(2-chlorophenyl)methyl]-3-[(E)-N-hydroxy-C-methyl-carbonimidoyl]-2-propyl-indole-6-carboxamide CAS Name: 1-[(2-chlorophenyl)methyl]-3-[(1E)-1-hydroxyiminoethyl]-2-propyl-6-indolecarboxamide IUPAC Name: 1-[(2-chlorophenyl)methyl]-3-[(E)-N-hydroxy-C-methylcarbonimidoyl]-2-propylindole-6-carboxamide Traditional Name: 3-acetohydroximoyl-1-(2-chlorobenzyl)-2-propyl-indole-6-carboxamide Formula: C21H22ClN3O2 MolecularWeight: 383.87128

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C2=C(N1CC3=CC=CC=C3Cl)C=C(C=C2)C(=O)N)C(=NO)C

Isomeric SMILES

CCCC1=C(C2=C(N1CC3=CC=CC=C3Cl)C=C(C=C2)C(=O)N)/C(=N/O)/C

InChI

InChI=1S/C21H22ClN3O2/c1-3-6-18-20(13(2)24-27)16-10-9-14(21(23)26)11-19(16)25(18)12-15-7-4-5-8-17(15)22/h4-5,7-11,27H,3,6,12H2,1-2H3,(H2,23,26)/b24-13+