3-[2-(2,5-dimethyl-1-propyl-pyrrol-3-yl)-2-oxidanylidene-ethyl]-4-oxidanylidene-phthalazine-1-carboxylate

Systemtic Name: 3-[2-(2,5-dimethyl-1-propyl-pyrrol-3-yl)-2-oxidanylidene-ethyl]-4-oxidanylidene-phthalazine-1-carboxylate Openeye Name: 3-[2-(2,5-dimethyl-1-propyl-pyrrol-3-yl)-2-oxo-ethyl]-4-oxo-phthalazine-1-carboxylate CAS Name: 3-[2-(2,5-dimethyl-1-propyl-3-pyrrolyl)-2-oxoethyl]-4-oxo-1-phthalazinecarboxylate IUPAC Name: 3-[2-(2,5-dimethyl-1-propylpyrrol-3-yl)-2-oxoethyl]-4-oxophthalazine-1-carboxylate Traditional Name: 3-[2-(2,5-dimethyl-1-propyl-pyrrol-3-yl)-2-keto-ethyl]-4-keto-phthalazine-1-carboxylate Formula: C20H20N3O4- MolecularWeight: 366.3905

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=CC(=C1C)C(=O)CN2C(=O)C3=CC=CC=C3C(=N2)C(=O)[O-])C

Isomeric SMILES

CCCN1C(=CC(=C1C)C(=O)CN2C(=O)C3=CC=CC=C3C(=N2)C(=O)[O-])C

InChI

InChI=1S/C20H21N3O4/c1-4-9-22-12(2)10-16(13(22)3)17(24)11-23-19(25)15-8-6-5-7-14(15)18(21-23)20(26)27/h5-8,10H,4,9,11H2,1-3H3,(H,26,27)/p-1