2-[4-(1,2,4-triazol-1-yl)butan-2-yl]isoindole-1,3-dione

Systemtic Name: 2-[4-(1,2,4-triazol-1-yl)butan-2-yl]isoindole-1,3-dione Openeye Name: 2-[1-methyl-3-(1,2,4-triazol-1-yl)propyl]isoindoline-1,3-dione CAS Name: 2-[4-(1,2,4-triazol-1-yl)butan-2-yl]isoindole-1,3-dione IUPAC Name: 2-[4-(1,2,4-triazol-1-yl)butan-2-yl]isoindole-1,3-dione Traditional Name: 2-[1-methyl-3-(1,2,4-triazol-1-yl)propyl]isoindoline-1,3-quinone Formula: C14H14N4O2 MolecularWeight: 270.28656

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCN1C=NC=N1)N2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CC(CCN1C=NC=N1)N2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C14H14N4O2/c1-10(6-7-17-9-15-8-16-17)18-13(19)11-4-2-3-5-12(11)14(18)20/h2-5,8-10H,6-7H2,1H3