N-[4-(4-methylpiperazin-1-yl)-5-oxidanylidene-cyclohepta-1,3,6-trien-1-yl]ethanamide

Systemtic Name: N-[4-(4-methylpiperazin-1-yl)-5-oxidanylidene-cyclohepta-1,3,6-trien-1-yl]ethanamide Openeye Name: N-[4-(4-methylpiperazin-1-yl)-5-oxo-cyclohepta-1,3,6-trien-1-yl]acetamide CAS Name: N-[4-(4-methyl-1-piperazinyl)-5-oxo-1-cyclohepta-1,3,6-trienyl]acetamide IUPAC Name: N-[4-(4-methylpiperazin-1-yl)-5-oxocyclohepta-1,3,6-trien-1-yl]acetamide Traditional Name: N-[5-keto-4-(4-methylpiperazino)cyclohepta-1,3,6-trien-1-yl]acetamide Formula: C14H19N3O2 MolecularWeight: 261.31956

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C(=O)C=C1)N2CCN(CC2)C

Isomeric SMILES

CC(=O)NC1=CC=C(C(=O)C=C1)N2CCN(CC2)C

InChI

InChI=1S/C14H19N3O2/c1-11(18)15-12-3-5-13(14(19)6-4-12)17-9-7-16(2)8-10-17/h3-6H,7-10H2,1-2H3,(H,15,18)