N-[(2S)-1-(cyclohexylmethylamino)-3-oxidanyl-1-oxidanylidene-propan-2-yl]quinoline-4-carboxamide

Systemtic Name: N-[(2S)-1-(cyclohexylmethylamino)-3-oxidanyl-1-oxidanylidene-propan-2-yl]quinoline-4-carboxamide Openeye Name: N-[(1S)-2-(cyclohexylmethylamino)-1-(hydroxymethyl)-2-oxo-ethyl]quinoline-4-carboxamide CAS Name: N-[(2S)-1-(cyclohexylmethylamino)-3-hydroxy-1-oxopropan-2-yl]-4-quinolinecarboxamide IUPAC Name: N-[(2S)-1-(cyclohexylmethylamino)-3-hydroxy-1-oxopropan-2-yl]quinoline-4-carboxamide Traditional Name: N-[(1S)-2-(cyclohexylmethylamino)-2-keto-1-methylol-ethyl]cinchoninamide Formula: C20H25N3O3 MolecularWeight: 355.4308

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CNC(=O)C(CO)NC(=O)C2=CC=NC3=CC=CC=C23

Isomeric SMILES

C1CCC(CC1)CNC(=O)[C@H](CO)NC(=O)C2=CC=NC3=CC=CC=C23

InChI

InChI=1S/C20H25N3O3/c24-13-18(20(26)22-12-14-6-2-1-3-7-14)23-19(25)16-10-11-21-17-9-5-4-8-15(16)17/h4-5,8-11,14,18,24H,1-3,6-7,12-13H2,(H,22,26)(H,23,25)/t18-/m0/s1