4-[[4-[(2-ethylquinolin-4-yl)methyl]phenyl]carbonylamino]-N-oxidanyl-1-prop-2-ynyl-pyrrolidine-3-carboxamide

Systemtic Name: 4-[[4-[(2-ethylquinolin-4-yl)methyl]phenyl]carbonylamino]-N-oxidanyl-1-prop-2-ynyl-pyrrolidine-3-carboxamide Openeye Name: 4-[(2-ethyl-4-quinolyl)methyl]-N-[4-(hydroxycarbamoyl)-1-prop-2-ynyl-pyrrolidin-3-yl]benzamide CAS Name: 4-[[[4-[(2-ethyl-4-quinolinyl)methyl]phenyl]-oxomethyl]amino]-N-hydroxy-1-prop-2-ynyl-3-pyrrolidinecarboxamide IUPAC Name: 4-[[4-[(2-ethylquinolin-4-yl)methyl]benzoyl]amino]-N-hydroxy-1-prop-2-ynylpyrrolidine-3-carboxamide Traditional Name: 4-[(2-ethyl-4-quinolyl)methyl]-N-[4-(hydroxycarbamoyl)-1-propargyl-pyrrolidin-3-yl]benzamide Formula: C27H28N4O3 MolecularWeight: 456.53622

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=CC=CC=C2C(=C1)CC3=CC=C(C=C3)C(=O)NC4CN(CC4C(=O)NO)CC#C

Isomeric SMILES

CCC1=NC2=CC=CC=C2C(=C1)CC3=CC=C(C=C3)C(=O)NC4CN(CC4C(=O)NO)CC#C

InChI

InChI=1S/C27H28N4O3/c1-3-13-31-16-23(27(33)30-34)25(17-31)29-26(32)19-11-9-18(10-12-19)14-20-15-21(4-2)28-24-8-6-5-7-22(20)24/h1,5-12,15,23,25,34H,4,13-14,16-17H2,2H3,(H,29,32)(H,30,33)