N-[1-(2-azanyl-2-oxidanylidene-ethyl)piperidin-4-yl]-7-fluoranyl-2-methyl-quinoline-3-carboxamide

Systemtic Name: N-[1-(2-azanyl-2-oxidanylidene-ethyl)piperidin-4-yl]-7-fluoranyl-2-methyl-quinoline-3-carboxamide Openeye Name: N-[1-(2-amino-2-oxo-ethyl)-4-piperidyl]-7-fluoro-2-methyl-quinoline-3-carboxamide CAS Name: N-[1-(2-amino-2-oxoethyl)-4-piperidinyl]-7-fluoro-2-methyl-3-quinolinecarboxamide IUPAC Name: N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-7-fluoro-2-methylquinoline-3-carboxamide Traditional Name: N-[1-(2-amino-2-keto-ethyl)-4-piperidyl]-7-fluoro-2-methyl-quinoline-3-carboxamide Formula: C18H21FN4O2 MolecularWeight: 344.383343

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C=CC(=CC2=N1)F)C(=O)NC3CCN(CC3)CC(=O)N

Isomeric SMILES

CC1=C(C=C2C=CC(=CC2=N1)F)C(=O)NC3CCN(CC3)CC(=O)N

InChI

InChI=1S/C18H21FN4O2/c1-11-15(8-12-2-3-13(19)9-16(12)21-11)18(25)22-14-4-6-23(7-5-14)10-17(20)24/h2-3,8-9,14H,4-7,10H2,1H3,(H2,20,24)(H,22,25)