N-[(2S)-2-(furan-2-yl)-2-piperidin-1-yl-ethyl]-2-methyl-quinoline-4-carboxamide

Systemtic Name: N-[(2S)-2-(furan-2-yl)-2-piperidin-1-yl-ethyl]-2-methyl-quinoline-4-carboxamide Openeye Name: N-[(2S)-2-(2-furyl)-2-(1-piperidyl)ethyl]-2-methyl-quinoline-4-carboxamide CAS Name: N-[(2S)-2-(2-furanyl)-2-(1-piperidinyl)ethyl]-2-methyl-4-quinolinecarboxamide IUPAC Name: N-[(2S)-2-(furan-2-yl)-2-piperidin-1-ylethyl]-2-methylquinoline-4-carboxamide Traditional Name: N-[(2S)-2-(2-furyl)-2-piperidino-ethyl]-2-methyl-cinchoninamide Formula: C22H25N3O2 MolecularWeight: 363.4528

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=C1)C(=O)NCC(C3=CC=CO3)N4CCCCC4

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=C1)C(=O)NC[C@@H](C3=CC=CO3)N4CCCCC4

InChI

InChI=1S/C22H25N3O2/c1-16-14-18(17-8-3-4-9-19(17)24-16)22(26)23-15-20(21-10-7-13-27-21)25-11-5-2-6-12-25/h3-4,7-10,13-14,20H,2,5-6,11-12,15H2,1H3,(H,23,26)/t20-/m0/s1