N'-[(3S)-1-(1,3-benzodioxol-5-yl)-5-oxidanylidene-pyrrolidin-3-yl]carbonyl-2-pyridin-3-yl-quinoline-4-carbohydrazide

Systemtic Name: N'-[(3S)-1-(1,3-benzodioxol-5-yl)-5-oxidanylidene-pyrrolidin-3-yl]carbonyl-2-pyridin-3-yl-quinoline-4-carbohydrazide Openeye Name: N'-[(3S)-1-(1,3-benzodioxol-5-yl)-5-oxo-pyrrolidine-3-carbonyl]-2-(3-pyridyl)quinoline-4-carbohydrazide CAS Name: N'-[[(3S)-1-(1,3-benzodioxol-5-yl)-5-oxo-3-pyrrolidinyl]-oxomethyl]-2-(3-pyridinyl)-4-quinolinecarbohydrazide IUPAC Name: N'-[(3S)-1-(1,3-benzodioxol-5-yl)-5-oxopyrrolidine-3-carbonyl]-2-pyridin-3-ylquinoline-4-carbohydrazide Traditional Name: N'-[(3S)-1-(1,3-benzodioxol-5-yl)-5-keto-pyrrolidine-3-carbonyl]-2-(3-pyridyl)cinchoninohydrazide Formula: C27H21N5O5 MolecularWeight: 495.48614

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C1=O)C2=CC3=C(C=C2)OCO3)C(=O)NNC(=O)C4=CC(=NC5=CC=CC=C54)C6=CN=CC=C6

Isomeric SMILES

C1[C@@H](CN(C1=O)C2=CC3=C(C=C2)OCO3)C(=O)NNC(=O)C4=CC(=NC5=CC=CC=C54)C6=CN=CC=C6

InChI

InChI=1S/C27H21N5O5/c33-25-10-17(14-32(25)18-7-8-23-24(11-18)37-15-36-23)26(34)30-31-27(35)20-12-22(16-4-3-9-28-13-16)29-21-6-2-1-5-19(20)21/h1-9,11-13,17H,10,14-15H2,(H,30,34)(H,31,35)/t17-/m0/s1