(3R)-N'-(4-methyl-3-pyrrol-1-yl-phenyl)carbonyl-2,3-dihydro-1,4-benzodioxine-3-carbohydrazide

Systemtic Name: (3R)-N'-(4-methyl-3-pyrrol-1-yl-phenyl)carbonyl-2,3-dihydro-1,4-benzodioxine-3-carbohydrazide Openeye Name: (3R)-N'-(4-methyl-3-pyrrol-1-yl-benzoyl)-2,3-dihydro-1,4-benzodioxine-3-carbohydrazide CAS Name: (3R)-N'-[[4-methyl-3-(1-pyrrolyl)phenyl]-oxomethyl]-2,3-dihydro-1,4-benzodioxin-3-carbohydrazide IUPAC Name: (3R)-N'-(4-methyl-3-pyrrol-1-ylbenzoyl)-2,3-dihydro-1,4-benzodioxine-3-carbohydrazide Traditional Name: (3R)-N'-(4-methyl-3-pyrrol-1-yl-benzoyl)-2,3-dihydro-1,4-benzodioxin-3-carbohydrazide Formula: C21H19N3O4 MolecularWeight: 377.39326

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NNC(=O)C2COC3=CC=CC=C3O2)N4C=CC=C4

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NNC(=O)[C@H]2COC3=CC=CC=C3O2)N4C=CC=C4

InChI

InChI=1S/C21H19N3O4/c1-14-8-9-15(12-16(14)24-10-4-5-11-24)20(25)22-23-21(26)19-13-27-17-6-2-3-7-18(17)28-19/h2-12,19H,13H2,1H3,(H,22,25)(H,23,26)/t19-/m1/s1