3-[2-(7-ethyl-1H-indol-3-yl)-2-oxidanylidene-ethyl]-4-oxidanylidene-phthalazine-1-carboxylate

Systemtic Name: 3-[2-(7-ethyl-1H-indol-3-yl)-2-oxidanylidene-ethyl]-4-oxidanylidene-phthalazine-1-carboxylate Openeye Name: 3-[2-(7-ethyl-1H-indol-3-yl)-2-oxo-ethyl]-4-oxo-phthalazine-1-carboxylate CAS Name: 3-[2-(7-ethyl-1H-indol-3-yl)-2-oxoethyl]-4-oxo-1-phthalazinecarboxylate IUPAC Name: 3-[2-(7-ethyl-1H-indol-3-yl)-2-oxoethyl]-4-oxophthalazine-1-carboxylate Traditional Name: 3-[2-(7-ethyl-1H-indol-3-yl)-2-keto-ethyl]-4-keto-phthalazine-1-carboxylate Formula: C21H16N3O4- MolecularWeight: 374.36944

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC2=C1NC=C2C(=O)CN3C(=O)C4=CC=CC=C4C(=N3)C(=O)[O-]

Isomeric SMILES

CCC1=CC=CC2=C1NC=C2C(=O)CN3C(=O)C4=CC=CC=C4C(=N3)C(=O)[O-]

InChI

InChI=1S/C21H17N3O4/c1-2-12-6-5-9-14-16(10-22-18(12)14)17(25)11-24-20(26)15-8-4-3-7-13(15)19(23-24)21(27)28/h3-10,22H,2,11H2,1H3,(H,27,28)/p-1