[(3S,5S)-5-methyl-2-oxidanylidene-oxolan-3-yl] 4-oxidanylidene-3-propyl-phthalazine-1-carboxylate

Systemtic Name: [(3S,5S)-5-methyl-2-oxidanylidene-oxolan-3-yl] 4-oxidanylidene-3-propyl-phthalazine-1-carboxylate Openeye Name: [(3S,5S)-5-methyl-2-oxo-tetrahydrofuran-3-yl] 4-oxo-3-propyl-phthalazine-1-carboxylate CAS Name: 4-oxo-3-propyl-1-phthalazinecarboxylic acid [(3S,5S)-5-methyl-2-oxo-3-oxolanyl] ester IUPAC Name: [(3S,5S)-5-methyl-2-oxooxolan-3-yl] 4-oxo-3-propylphthalazine-1-carboxylate Traditional Name: 4-keto-3-propyl-phthalazine-1-carboxylic acid [(3S,5S)-2-keto-5-methyl-tetrahydrofuran-3-yl] ester Formula: C17H18N2O5 MolecularWeight: 330.33522

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OC3CC(OC3=O)C

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)O[C@H]3C[C@@H](OC3=O)C

InChI

InChI=1S/C17H18N2O5/c1-3-8-19-15(20)12-7-5-4-6-11(12)14(18-19)17(22)24-13-9-10(2)23-16(13)21/h4-7,10,13H,3,8-9H2,1-2H3/t10-,13-/m0/s1