N-[(2S)-2-(4-nitrophenyl)-2-oxidanyl-ethyl]quinoline-2-carboxamide

Systemtic Name: N-[(2S)-2-(4-nitrophenyl)-2-oxidanyl-ethyl]quinoline-2-carboxamide Openeye Name: N-[(2S)-2-hydroxy-2-(4-nitrophenyl)ethyl]quinoline-2-carboxamide CAS Name: N-[(2S)-2-hydroxy-2-(4-nitrophenyl)ethyl]-2-quinolinecarboxamide IUPAC Name: N-[(2S)-2-hydroxy-2-(4-nitrophenyl)ethyl]quinoline-2-carboxamide Traditional Name: N-[(2S)-2-hydroxy-2-(4-nitrophenyl)ethyl]quinaldamide Formula: C18H15N3O4 MolecularWeight: 337.3294

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=N2)C(=O)NCC(C3=CC=C(C=C3)[N+](=O)[O-])O

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=N2)C(=O)NC[C@H](C3=CC=C(C=C3)[N+](=O)[O-])O

InChI

InChI=1S/C18H15N3O4/c22-17(13-5-8-14(9-6-13)21(24)25)11-19-18(23)16-10-7-12-3-1-2-4-15(12)20-16/h1-10,17,22H,11H2,(H,19,23)/t17-/m1/s1