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

Systemtic Name: N-[(2S)-1-(cyclopentylamino)-3-oxidanyl-1-oxidanylidene-propan-2-yl]quinoline-4-carboxamide Openeye Name: N-[(1S)-2-(cyclopentylamino)-1-(hydroxymethyl)-2-oxo-ethyl]quinoline-4-carboxamide CAS Name: N-[(2S)-1-(cyclopentylamino)-3-hydroxy-1-oxopropan-2-yl]-4-quinolinecarboxamide IUPAC Name: N-[(2S)-1-(cyclopentylamino)-3-hydroxy-1-oxopropan-2-yl]quinoline-4-carboxamide Traditional Name: N-[(1S)-2-(cyclopentylamino)-2-keto-1-methylol-ethyl]cinchoninamide Formula: C18H21N3O3 MolecularWeight: 327.37764

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC(=O)C(CO)NC(=O)C2=CC=NC3=CC=CC=C23

Isomeric SMILES

C1CCC(C1)NC(=O)[C@H](CO)NC(=O)C2=CC=NC3=CC=CC=C23

InChI

InChI=1S/C18H21N3O3/c22-11-16(18(24)20-12-5-1-2-6-12)21-17(23)14-9-10-19-15-8-4-3-7-13(14)15/h3-4,7-10,12,16,22H,1-2,5-6,11H2,(H,20,24)(H,21,23)/t16-/m0/s1