3-[azanyl-(4-phenylpiperazin-1-yl)methylidene]pentane-2,4-dione

Systemtic Name: 3-[azanyl-(4-phenylpiperazin-1-yl)methylidene]pentane-2,4-dione Openeye Name: 3-[amino-(4-phenylpiperazin-1-yl)methylene]pentane-2,4-dione CAS Name: 3-[amino-(4-phenyl-1-piperazinyl)methylidene]pentane-2,4-dione IUPAC Name: 3-[amino-(4-phenylpiperazin-1-yl)methylidene]pentane-2,4-dione Traditional Name: 3-[amino-(4-phenylpiperazino)methylene]pentane-2,4-dione Formula: C16H21N3O2 MolecularWeight: 287.35684

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=C(N)N1CCN(CC1)C2=CC=CC=C2)C(=O)C

Isomeric SMILES

CC(=O)C(=C(N)N1CCN(CC1)C2=CC=CC=C2)C(=O)C

InChI

InChI=1S/C16H21N3O2/c1-12(20)15(13(2)21)16(17)19-10-8-18(9-11-19)14-6-4-3-5-7-14/h3-7H,8-11,17H2,1-2H3