N2-(diethoxyphosphorylmethyl)-4-piperidin-1-yl-5-(trifluoromethyl)benzene-1,2-diamine

Systemtic Name: N2-(diethoxyphosphorylmethyl)-4-piperidin-1-yl-5-(trifluoromethyl)benzene-1,2-diamine Openeye Name: N2-(diethoxyphosphorylmethyl)-4-(1-piperidyl)-5-(trifluoromethyl)benzene-1,2-diamine CAS Name: N2-(diethoxyphosphorylmethyl)-4-(1-piperidinyl)-5-(trifluoromethyl)benzene-1,2-diamine IUPAC Name: 2-N-(diethoxyphosphorylmethyl)-4-piperidin-1-yl-5-(trifluoromethyl)benzene-1,2-diamine Traditional Name: [2-amino-5-piperidino-4-(trifluoromethyl)phenyl]-(diethoxyphosphorylmethyl)amine Formula: C17H27F3N3O3P MolecularWeight: 409.383551

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(CNC1=C(C=C(C(=C1)N2CCCCC2)C(F)(F)F)N)OCC

Isomeric SMILES

CCOP(=O)(CNC1=C(C=C(C(=C1)N2CCCCC2)C(F)(F)F)N)OCC

InChI

InChI=1S/C17H27F3N3O3P/c1-3-25-27(24,26-4-2)12-22-15-11-16(23-8-6-5-7-9-23)13(10-14(15)21)17(18,19)20/h10-11,22H,3-9,12,21H2,1-2H3