1-[2-(2-oxidanylidene-2-pyrrolidin-3-yl-ethyl)piperazin-1-yl]-4-(3,4,5-trimethoxyphenyl)but-3-en-1-one

Systemtic Name: 1-[2-(2-oxidanylidene-2-pyrrolidin-3-yl-ethyl)piperazin-1-yl]-4-(3,4,5-trimethoxyphenyl)but-3-en-1-one Openeye Name: 1-[2-(2-oxo-2-pyrrolidin-3-yl-ethyl)piperazin-1-yl]-4-(3,4,5-trimethoxyphenyl)but-3-en-1-one CAS Name: 1-[2-[2-oxo-2-(3-pyrrolidinyl)ethyl]-1-piperazinyl]-4-(3,4,5-trimethoxyphenyl)-3-buten-1-one IUPAC Name: 1-[2-(2-oxo-2-pyrrolidin-3-ylethyl)piperazin-1-yl]-4-(3,4,5-trimethoxyphenyl)but-3-en-1-one Traditional Name: 1-[2-(2-keto-2-pyrrolidin-3-yl-ethyl)piperazino]-4-(3,4,5-trimethoxyphenyl)but-3-en-1-one Formula: C23H33N3O5 MolecularWeight: 431.52522

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C=CCC(=O)N2CCNCC2CC(=O)C3CCNC3

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C=CCC(=O)N2CCNCC2CC(=O)C3CCNC3

InChI

InChI=1S/C23H33N3O5/c1-29-20-11-16(12-21(30-2)23(20)31-3)5-4-6-22(28)26-10-9-25-15-18(26)13-19(27)17-7-8-24-14-17/h4-5,11-12,17-18,24-25H,6-10,13-15H2,1-3H3