2,6-ditert-butyl-4-[[[4-(4-chlorophenyl)piperazin-1-yl]amino]methylidene]cyclohexa-2,5-dien-1-one

Systemtic Name: 2,6-ditert-butyl-4-[[[4-(4-chlorophenyl)piperazin-1-yl]amino]methylidene]cyclohexa-2,5-dien-1-one Openeye Name: 2,6-ditert-butyl-4-[[[4-(4-chlorophenyl)piperazin-1-yl]amino]methylene]cyclohexa-2,5-dien-1-one CAS Name: 2,6-ditert-butyl-4-[[[4-(4-chlorophenyl)-1-piperazinyl]amino]methylidene]-1-cyclohexa-2,5-dienone IUPAC Name: 2,6-ditert-butyl-4-[[[4-(4-chlorophenyl)piperazin-1-yl]amino]methylidene]cyclohexa-2,5-dien-1-one Traditional Name: 2,6-ditert-butyl-4-[[[4-(4-chlorophenyl)piperazino]amino]methylene]cyclohexa-2,5-dien-1-one Formula: C25H34ClN3O MolecularWeight: 428.00996

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CNN2CCN(CC2)C3=CC=C(C=C3)Cl)C=C(C1=O)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC(=CNN2CCN(CC2)C3=CC=C(C=C3)Cl)C=C(C1=O)C(C)(C)C

InChI

InChI=1S/C25H34ClN3O/c1-24(2,3)21-15-18(16-22(23(21)30)25(4,5)6)17-27-29-13-11-28(12-14-29)20-9-7-19(26)8-10-20/h7-10,15-17,27H,11-14H2,1-6H3