4-methoxy-N-[3-[4-(oxidanylcarbamoyl)phenyl]prop-2-ynyl]quinoline-2-carboxamide

Systemtic Name: 4-methoxy-N-[3-[4-(oxidanylcarbamoyl)phenyl]prop-2-ynyl]quinoline-2-carboxamide Openeye Name: N-[3-[4-(hydroxycarbamoyl)phenyl]prop-2-ynyl]-4-methoxy-quinoline-2-carboxamide CAS Name: N-[3-[4-[(hydroxyamino)-oxomethyl]phenyl]prop-2-ynyl]-4-methoxy-2-quinolinecarboxamide IUPAC Name: N-[3-[4-(hydroxycarbamoyl)phenyl]prop-2-ynyl]-4-methoxyquinoline-2-carboxamide Traditional Name: N-[3-[4-(hydroxycarbamoyl)phenyl]prop-2-ynyl]-4-methoxy-quinaldamide Formula: C21H17N3O4 MolecularWeight: 375.37738

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=NC2=CC=CC=C21)C(=O)NCC#CC3=CC=C(C=C3)C(=O)NO

Isomeric SMILES

COC1=CC(=NC2=CC=CC=C21)C(=O)NCC#CC3=CC=C(C=C3)C(=O)NO

InChI

InChI=1S/C21H17N3O4/c1-28-19-13-18(23-17-7-3-2-6-16(17)19)21(26)22-12-4-5-14-8-10-15(11-9-14)20(25)24-27/h2-3,6-11,13,27H,12H2,1H3,(H,22,26)(H,24,25)