N'-[2-[(1S)-2-ethanoyl-1H-isoquinolin-1-yl]ethanoyl]-1,3-benzodioxole-5-carbohydrazide

Systemtic Name: N'-[2-[(1S)-2-ethanoyl-1H-isoquinolin-1-yl]ethanoyl]-1,3-benzodioxole-5-carbohydrazide Openeye Name: N'-[2-[(1S)-2-acetyl-1H-isoquinolin-1-yl]acetyl]-1,3-benzodioxole-5-carbohydrazide CAS Name: N'-[2-[(1S)-2-acetyl-1H-isoquinolin-1-yl]-1-oxoethyl]-1,3-benzodioxole-5-carbohydrazide IUPAC Name: N'-[2-[(1S)-2-acetyl-1H-isoquinolin-1-yl]acetyl]-1,3-benzodioxole-5-carbohydrazide Traditional Name: N'-[2-[(1S)-2-acetyl-1H-isoquinolin-1-yl]acetyl]-1,3-benzodioxole-5-carbohydrazide Formula: C21H19N3O5 MolecularWeight: 393.39266

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C=CC2=CC=CC=C2C1CC(=O)NNC(=O)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC(=O)N1C=CC2=CC=CC=C2[C@@H]1CC(=O)NNC(=O)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C21H19N3O5/c1-13(25)24-9-8-14-4-2-3-5-16(14)17(24)11-20(26)22-23-21(27)15-6-7-18-19(10-15)29-12-28-18/h2-10,17H,11-12H2,1H3,(H,22,26)(H,23,27)/t17-/m0/s1