methyl 2-[[4-[(4-fluorophenyl)carbonylamino]piperidin-1-yl]methyl]-4-oxidanylidene-1H-quinazoline-7-carboxylate

Systemtic Name: methyl 2-[[4-[(4-fluorophenyl)carbonylamino]piperidin-1-yl]methyl]-4-oxidanylidene-1H-quinazoline-7-carboxylate Openeye Name: methyl 2-[[4-[(4-fluorobenzoyl)amino]-1-piperidyl]methyl]-4-oxo-1H-quinazoline-7-carboxylate CAS Name: 2-[[4-[[(4-fluorophenyl)-oxomethyl]amino]-1-piperidinyl]methyl]-4-oxo-1H-quinazoline-7-carboxylic acid methyl ester IUPAC Name: methyl 2-[[4-[(4-fluorobenzoyl)amino]piperidin-1-yl]methyl]-4-oxo-1H-quinazoline-7-carboxylate Traditional Name: 2-[[4-[(4-fluorobenzoyl)amino]piperidino]methyl]-4-keto-1H-quinazoline-7-carboxylic acid methyl ester Formula: C23H23FN4O4 MolecularWeight: 438.451523

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)C(=O)N=C(N2)CN3CCC(CC3)NC(=O)C4=CC=C(C=C4)F

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)C(=O)N=C(N2)CN3CCC(CC3)NC(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C23H23FN4O4/c1-32-23(31)15-4-7-18-19(12-15)26-20(27-22(18)30)13-28-10-8-17(9-11-28)25-21(29)14-2-5-16(24)6-3-14/h2-7,12,17H,8-11,13H2,1H3,(H,25,29)(H,26,27,30)