1-[(2R,4S)-3-methylidene-4-oxidanyl-octan-2-yl]-4-phenyl-1,2,4-triazolidine-3,5-dione

Systemtic Name: 1-[(2R,4S)-3-methylidene-4-oxidanyl-octan-2-yl]-4-phenyl-1,2,4-triazolidine-3,5-dione Openeye Name: 1-[(1R,3S)-3-hydroxy-1-methyl-2-methylene-heptyl]-4-phenyl-1,2,4-triazolidine-3,5-dione CAS Name: 1-[(2R,4S)-4-hydroxy-3-methyleneoctan-2-yl]-4-phenyl-1,2,4-triazolidine-3,5-dione IUPAC Name: 1-[(2R,4S)-4-hydroxy-3-methylideneoctan-2-yl]-4-phenyl-1,2,4-triazolidine-3,5-dione Traditional Name: 1-[(1R)-2-[(1S)-1-hydroxypentyl]-1-methyl-allyl]-4-phenyl-urazole Formula: C17H23N3O3 MolecularWeight: 317.38282

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=C)C(C)N1C(=O)N(C(=O)N1)C2=CC=CC=C2)O

Isomeric SMILES

CCCC[C@@H](C(=C)[C@@H](C)N1C(=O)N(C(=O)N1)C2=CC=CC=C2)O

InChI

InChI=1S/C17H23N3O3/c1-4-5-11-15(21)12(2)13(3)20-17(23)19(16(22)18-20)14-9-7-6-8-10-14/h6-10,13,15,21H,2,4-5,11H2,1,3H3,(H,18,22)/t13-,15+/m1/s1