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

Systemtic Name: N-[(2S)-1-[4-(2-methoxyphenyl)piperazin-1-yl]-3-oxidanyl-1-oxidanylidene-propan-2-yl]quinoline-4-carboxamide Openeye Name: N-[(1S)-1-(hydroxymethyl)-2-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxo-ethyl]quinoline-4-carboxamide CAS Name: N-[(2S)-3-hydroxy-1-[4-(2-methoxyphenyl)-1-piperazinyl]-1-oxopropan-2-yl]-4-quinolinecarboxamide IUPAC Name: N-[(2S)-3-hydroxy-1-[4-(2-methoxyphenyl)piperazin-1-yl]-1-oxopropan-2-yl]quinoline-4-carboxamide Traditional Name: N-[(1S)-2-keto-2-[4-(2-methoxyphenyl)piperazino]-1-methylol-ethyl]cinchoninamide Formula: C24H26N4O4 MolecularWeight: 434.48764

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)C(=O)C(CO)NC(=O)C3=CC=NC4=CC=CC=C34

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)C(=O)[C@H](CO)NC(=O)C3=CC=NC4=CC=CC=C34

InChI

InChI=1S/C24H26N4O4/c1-32-22-9-5-4-8-21(22)27-12-14-28(15-13-27)24(31)20(16-29)26-23(30)18-10-11-25-19-7-3-2-6-17(18)19/h2-11,20,29H,12-16H2,1H3,(H,26,30)/t20-/m0/s1