ethyl 3-[4-[(4-fluorophenyl)carbonylamino]piperidin-1-yl]carbonyl-5-nitro-benzoate

Systemtic Name: ethyl 3-[4-[(4-fluorophenyl)carbonylamino]piperidin-1-yl]carbonyl-5-nitro-benzoate Openeye Name: ethyl 3-[4-[(4-fluorobenzoyl)amino]piperidine-1-carbonyl]-5-nitro-benzoate CAS Name: 3-[[4-[[(4-fluorophenyl)-oxomethyl]amino]-1-piperidinyl]-oxomethyl]-5-nitrobenzoic acid ethyl ester IUPAC Name: ethyl 3-[4-[(4-fluorobenzoyl)amino]piperidine-1-carbonyl]-5-nitrobenzoate Traditional Name: 3-[4-[(4-fluorobenzoyl)amino]piperidine-1-carbonyl]-5-nitro-benzoic acid ethyl ester Formula: C22H22FN3O6 MolecularWeight: 443.424983

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1)C(=O)N2CCC(CC2)NC(=O)C3=CC=C(C=C3)F)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)C(=O)N2CCC(CC2)NC(=O)C3=CC=C(C=C3)F)[N+](=O)[O-]

InChI

InChI=1S/C22H22FN3O6/c1-2-32-22(29)16-11-15(12-19(13-16)26(30)31)21(28)25-9-7-18(8-10-25)24-20(27)14-3-5-17(23)6-4-14/h3-6,11-13,18H,2,7-10H2,1H3,(H,24,27)