4-[[[4,4-dimethyl-2,6-bis(oxidanylidene)cyclohexylidene]methylamino]methyl]-N-phenyl-piperazine-1-carboxamide

Systemtic Name: 4-[[[4,4-dimethyl-2,6-bis(oxidanylidene)cyclohexylidene]methylamino]methyl]-N-phenyl-piperazine-1-carboxamide Openeye Name: 4-[[(4,4-dimethyl-2,6-dioxo-cyclohexylidene)methylamino]methyl]-N-phenyl-piperazine-1-carboxamide CAS Name: 4-[[(4,4-dimethyl-2,6-dioxocyclohexylidene)methylamino]methyl]-N-phenyl-1-piperazinecarboxamide IUPAC Name: 4-[[(4,4-dimethyl-2,6-dioxocyclohexylidene)methylamino]methyl]-N-phenylpiperazine-1-carboxamide Traditional Name: 4-[[(2,6-diketo-4,4-dimethyl-cyclohexylidene)methylamino]methyl]-N-phenyl-piperazine-1-carboxamide Formula: C21H28N4O3 MolecularWeight: 384.47202

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)C(=CNCN2CCN(CC2)C(=O)NC3=CC=CC=C3)C(=O)C1)C

Isomeric SMILES

CC1(CC(=O)C(=CNCN2CCN(CC2)C(=O)NC3=CC=CC=C3)C(=O)C1)C

InChI

InChI=1S/C21H28N4O3/c1-21(2)12-18(26)17(19(27)13-21)14-22-15-24-8-10-25(11-9-24)20(28)23-16-6-4-3-5-7-16/h3-7,14,22H,8-13,15H2,1-2H3,(H,23,28)