N-[(3-ethoxyphenyl)methyl]-3,4-bis(fluoranyl)-N-(2-oxidanylidene-2-piperazin-1-yl-ethyl)benzamide

Systemtic Name: N-[(3-ethoxyphenyl)methyl]-3,4-bis(fluoranyl)-N-(2-oxidanylidene-2-piperazin-1-yl-ethyl)benzamide Openeye Name: N-[(3-ethoxyphenyl)methyl]-3,4-difluoro-N-(2-oxo-2-piperazin-1-yl-ethyl)benzamide CAS Name: N-[(3-ethoxyphenyl)methyl]-3,4-difluoro-N-[2-oxo-2-(1-piperazinyl)ethyl]benzamide IUPAC Name: N-[(3-ethoxyphenyl)methyl]-3,4-difluoro-N-(2-oxo-2-piperazin-1-ylethyl)benzamide Traditional Name: N-(3-ethoxybenzyl)-3,4-difluoro-N-(2-keto-2-piperazino-ethyl)benzamide Formula: C22H25F2N3O3 MolecularWeight: 417.449006

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)CN(CC(=O)N2CCNCC2)C(=O)C3=CC(=C(C=C3)F)F

Isomeric SMILES

CCOC1=CC=CC(=C1)CN(CC(=O)N2CCNCC2)C(=O)C3=CC(=C(C=C3)F)F

InChI

InChI=1S/C22H25F2N3O3/c1-2-30-18-5-3-4-16(12-18)14-27(15-21(28)26-10-8-25-9-11-26)22(29)17-6-7-19(23)20(24)13-17/h3-7,12-13,25H,2,8-11,14-15H2,1H3