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

Systemtic Name: N-[(2S)-1-(cyclohexylamino)-3-oxidanyl-1-oxidanylidene-propan-2-yl]quinoline-4-carboxamide Openeye Name: N-[(1S)-2-(cyclohexylamino)-1-(hydroxymethyl)-2-oxo-ethyl]quinoline-4-carboxamide CAS Name: N-[(2S)-1-(cyclohexylamino)-3-hydroxy-1-oxopropan-2-yl]-4-quinolinecarboxamide IUPAC Name: N-[(2S)-1-(cyclohexylamino)-3-hydroxy-1-oxopropan-2-yl]quinoline-4-carboxamide Traditional Name: N-[(1S)-2-(cyclohexylamino)-2-keto-1-methylol-ethyl]cinchoninamide Formula: C19H23N3O3 MolecularWeight: 341.40422

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H23N3O3/c23-12-17(19(25)21-13-6-2-1-3-7-13)22-18(24)15-10-11-20-16-9-5-4-8-14(15)16/h4-5,8-11,13,17,23H,1-3,6-7,12H2,(H,21,25)(H,22,24)/t17-/m0/s1