4-[4-[2-(ethylamino)-2-oxidanylidene-1-phenyl-ethyl]piperidin-1-yl]-3-fluoranyl-N-pentan-3-yl-benzamide

Systemtic Name: 4-[4-[2-(ethylamino)-2-oxidanylidene-1-phenyl-ethyl]piperidin-1-yl]-3-fluoranyl-N-pentan-3-yl-benzamide Openeye Name: 4-[4-[2-(ethylamino)-2-oxo-1-phenyl-ethyl]-1-piperidyl]-N-(1-ethylpropyl)-3-fluoro-benzamide CAS Name: 4-[4-[2-(ethylamino)-2-oxo-1-phenylethyl]-1-piperidinyl]-3-fluoro-N-pentan-3-ylbenzamide IUPAC Name: 4-[4-[2-(ethylamino)-2-oxo-1-phenylethyl]piperidin-1-yl]-3-fluoro-N-pentan-3-ylbenzamide Traditional Name: 4-[4-[2-(ethylamino)-2-keto-1-phenyl-ethyl]piperidino]-N-(1-ethylpropyl)-3-fluoro-benzamide Formula: C27H36FN3O2 MolecularWeight: 453.592043

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NC(=O)C1=CC(=C(C=C1)N2CCC(CC2)C(C3=CC=CC=C3)C(=O)NCC)F

Isomeric SMILES

CCC(CC)NC(=O)C1=CC(=C(C=C1)N2CCC(CC2)C(C3=CC=CC=C3)C(=O)NCC)F

InChI

InChI=1S/C27H36FN3O2/c1-4-22(5-2)30-26(32)21-12-13-24(23(28)18-21)31-16-14-20(15-17-31)25(27(33)29-6-3)19-10-8-7-9-11-19/h7-13,18,20,22,25H,4-6,14-17H2,1-3H3,(H,29,33)(H,30,32)