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

Systemtic Name: 4-[(E)-3-(4-methoxyphenyl)prop-2-enoyl]-3-[2-oxidanylidene-2-(4-phenylpiperazin-1-yl)ethyl]piperazin-2-one Openeye Name: 4-[(E)-3-(4-methoxyphenyl)prop-2-enoyl]-3-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]piperazin-2-one CAS Name: 4-[(E)-3-(4-methoxyphenyl)-1-oxoprop-2-enyl]-3-[2-oxo-2-(4-phenyl-1-piperazinyl)ethyl]-2-piperazinone IUPAC Name: 4-[(E)-3-(4-methoxyphenyl)prop-2-enoyl]-3-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]piperazin-2-one Traditional Name: 3-[2-keto-2-(4-phenylpiperazino)ethyl]-4-[(E)-3-(4-methoxyphenyl)acryloyl]piperazin-2-one Formula: C26H30N4O4 MolecularWeight: 462.5408

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C=CC(=O)N2CCNC(=O)C2CC(=O)N3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)/C=C/C(=O)N2CCNC(=O)C2CC(=O)N3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C26H30N4O4/c1-34-22-10-7-20(8-11-22)9-12-24(31)30-14-13-27-26(33)23(30)19-25(32)29-17-15-28(16-18-29)21-5-3-2-4-6-21/h2-12,23H,13-19H2,1H3,(H,27,33)/b12-9+