3-[2-(azocan-1-yl)-2-oxidanylidene-ethyl]-4-[(2,3-dimethoxyphenyl)methyl]piperazin-2-one

Systemtic Name: 3-[2-(azocan-1-yl)-2-oxidanylidene-ethyl]-4-[(2,3-dimethoxyphenyl)methyl]piperazin-2-one Openeye Name: 3-[2-(azocan-1-yl)-2-oxo-ethyl]-4-[(2,3-dimethoxyphenyl)methyl]piperazin-2-one CAS Name: 3-[2-(1-azocanyl)-2-oxoethyl]-4-[(2,3-dimethoxyphenyl)methyl]-2-piperazinone IUPAC Name: 3-[2-(azocan-1-yl)-2-oxoethyl]-4-[(2,3-dimethoxyphenyl)methyl]piperazin-2-one Traditional Name: 3-[2-(azocan-1-yl)-2-keto-ethyl]-4-o-veratryl-piperazin-2-one Formula: C22H33N3O4 MolecularWeight: 403.51512

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)CN2CCNC(=O)C2CC(=O)N3CCCCCCC3

Isomeric SMILES

COC1=CC=CC(=C1OC)CN2CCNC(=O)C2CC(=O)N3CCCCCCC3

InChI

InChI=1S/C22H33N3O4/c1-28-19-10-8-9-17(21(19)29-2)16-25-14-11-23-22(27)18(25)15-20(26)24-12-6-4-3-5-7-13-24/h8-10,18H,3-7,11-16H2,1-2H3,(H,23,27)