4-[(E)-but-2-enoyl]-3-[2-oxidanylidene-2-(4-phenylpiperazin-1-yl)ethyl]piperazin-2-one

Systemtic Name: 4-[(E)-but-2-enoyl]-3-[2-oxidanylidene-2-(4-phenylpiperazin-1-yl)ethyl]piperazin-2-one Openeye Name: 4-[(E)-but-2-enoyl]-3-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]piperazin-2-one CAS Name: 4-[(E)-1-oxobut-2-enyl]-3-[2-oxo-2-(4-phenyl-1-piperazinyl)ethyl]-2-piperazinone IUPAC Name: 4-[(E)-but-2-enoyl]-3-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]piperazin-2-one Traditional Name: 4-[(E)-but-2-enoyl]-3-[2-keto-2-(4-phenylpiperazino)ethyl]piperazin-2-one Formula: C20H26N4O3 MolecularWeight: 370.44544

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC(=O)N1CCNC(=O)C1CC(=O)N2CCN(CC2)C3=CC=CC=C3

Isomeric SMILES

C/C=C/C(=O)N1CCNC(=O)C1CC(=O)N2CCN(CC2)C3=CC=CC=C3

InChI

InChI=1S/C20H26N4O3/c1-2-6-18(25)24-10-9-21-20(27)17(24)15-19(26)23-13-11-22(12-14-23)16-7-4-3-5-8-16/h2-8,17H,9-15H2,1H3,(H,21,27)/b6-2+