3-[3-[[(2S)-2-methyl-3-oxidanylidene-4H-1,4-benzoxazin-6-yl]amino]-3-oxidanylidene-propyl]-4-oxidanylidene-phthalazin-1-olate

Systemtic Name: 3-[3-[[(2S)-2-methyl-3-oxidanylidene-4H-1,4-benzoxazin-6-yl]amino]-3-oxidanylidene-propyl]-4-oxidanylidene-phthalazin-1-olate Openeye Name: 3-[3-[[(2S)-2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl]amino]-3-oxo-propyl]-4-oxo-phthalazin-1-olate CAS Name: 3-[3-[[(2S)-2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl]amino]-3-oxopropyl]-4-oxo-1-phthalazinolate IUPAC Name: 3-[3-[[(2S)-2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl]amino]-3-oxopropyl]-4-oxophthalazin-1-olate Traditional Name: 4-keto-3-[3-keto-3-[[(2S)-3-keto-2-methyl-4H-1,4-benzoxazin-6-yl]amino]propyl]phthalazin-1-olate Formula: C20H17N4O5- MolecularWeight: 393.37278

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)NC2=C(O1)C=CC(=C2)NC(=O)CCN3C(=O)C4=CC=CC=C4C(=N3)[O-]

Isomeric SMILES

C[C@H]1C(=O)NC2=C(O1)C=CC(=C2)NC(=O)CCN3C(=O)C4=CC=CC=C4C(=N3)[O-]

InChI

InChI=1S/C20H18N4O5/c1-11-18(26)22-15-10-12(6-7-16(15)29-11)21-17(25)8-9-24-20(28)14-5-3-2-4-13(14)19(27)23-24/h2-7,10-11H,8-9H2,1H3,(H,21,25)(H,22,26)(H,23,27)/p-1/t11-/m0/s1