N-[3-[(3-acetamidopyrrolidin-1-yl)methyl]quinolin-7-yl]-4-(4-fluorophenyl)benzamide

Systemtic Name: N-[3-[(3-acetamidopyrrolidin-1-yl)methyl]quinolin-7-yl]-4-(4-fluorophenyl)benzamide Openeye Name: N-[3-[(3-acetamidopyrrolidin-1-yl)methyl]-7-quinolyl]-4-(4-fluorophenyl)benzamide CAS Name: N-[3-[(3-acetamido-1-pyrrolidinyl)methyl]-7-quinolinyl]-4-(4-fluorophenyl)benzamide IUPAC Name: N-[3-[(3-acetamidopyrrolidin-1-yl)methyl]quinolin-7-yl]-4-(4-fluorophenyl)benzamide Traditional Name: N-[3-[(3-acetamidopyrrolidino)methyl]-7-quinolyl]-4-(4-fluorophenyl)benzamide Formula: C29H27FN4O2 MolecularWeight: 482.548683

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1CCN(C1)CC2=CN=C3C=C(C=CC3=C2)NC(=O)C4=CC=C(C=C4)C5=CC=C(C=C5)F

Isomeric SMILES

CC(=O)NC1CCN(C1)CC2=CN=C3C=C(C=CC3=C2)NC(=O)C4=CC=C(C=C4)C5=CC=C(C=C5)F

InChI

InChI=1S/C29H27FN4O2/c1-19(35)32-27-12-13-34(18-27)17-20-14-24-8-11-26(15-28(24)31-16-20)33-29(36)23-4-2-21(3-5-23)22-6-9-25(30)10-7-22/h2-11,14-16,27H,12-13,17-18H2,1H3,(H,32,35)(H,33,36)