6-[[[4-(4-ethanoylpiperazin-1-yl)phenyl]amino]methylidene]-2-methoxy-4-nitro-cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[[[4-(4-ethanoylpiperazin-1-yl)phenyl]amino]methylidene]-2-methoxy-4-nitro-cyclohexa-2,4-dien-1-one Openeye Name: 6-[[4-(4-acetylpiperazin-1-yl)anilino]methylene]-2-methoxy-4-nitro-cyclohexa-2,4-dien-1-one CAS Name: 6-[[4-(4-acetyl-1-piperazinyl)anilino]methylidene]-2-methoxy-4-nitro-1-cyclohexa-2,4-dienone IUPAC Name: 6-[[4-(4-acetylpiperazin-1-yl)anilino]methylidene]-2-methoxy-4-nitrocyclohexa-2,4-dien-1-one Traditional Name: 6-[[4-(4-acetylpiperazino)anilino]methylene]-2-methoxy-4-nitro-cyclohexa-2,4-dien-1-one Formula: C20H22N4O5 MolecularWeight: 398.41248

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C2=CC=C(C=C2)NC=C3C=C(C=C(C3=O)OC)[N+](=O)[O-]

Isomeric SMILES

CC(=O)N1CCN(CC1)C2=CC=C(C=C2)NC=C3C=C(C=C(C3=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C20H22N4O5/c1-14(25)22-7-9-23(10-8-22)17-5-3-16(4-6-17)21-13-15-11-18(24(27)28)12-19(29-2)20(15)26/h3-6,11-13,21H,7-10H2,1-2H3