6-[[[4-(4-butanoylpiperazin-1-yl)phenyl]amino]methylidene]-4-chloranyl-2-ethoxy-cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[[[4-(4-butanoylpiperazin-1-yl)phenyl]amino]methylidene]-4-chloranyl-2-ethoxy-cyclohexa-2,4-dien-1-one Openeye Name: 6-[[4-(4-butanoylpiperazin-1-yl)anilino]methylene]-4-chloro-2-ethoxy-cyclohexa-2,4-dien-1-one CAS Name: 4-chloro-2-ethoxy-6-[[4-[4-(1-oxobutyl)-1-piperazinyl]anilino]methylidene]-1-cyclohexa-2,4-dienone IUPAC Name: 6-[[4-(4-butanoylpiperazin-1-yl)anilino]methylidene]-4-chloro-2-ethoxycyclohexa-2,4-dien-1-one Traditional Name: 6-[[4-(4-butyrylpiperazino)anilino]methylene]-4-chloro-2-ethoxy-cyclohexa-2,4-dien-1-one Formula: C23H28ClN3O3 MolecularWeight: 429.93972

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)N1CCN(CC1)C2=CC=C(C=C2)NC=C3C=C(C=C(C3=O)OCC)Cl

Isomeric SMILES

CCCC(=O)N1CCN(CC1)C2=CC=C(C=C2)NC=C3C=C(C=C(C3=O)OCC)Cl

InChI

InChI=1S/C23H28ClN3O3/c1-3-5-22(28)27-12-10-26(11-13-27)20-8-6-19(7-9-20)25-16-17-14-18(24)15-21(23(17)29)30-4-2/h6-9,14-16,25H,3-5,10-13H2,1-2H3