3-[2-[[4-[ethyl(propan-2-yl)amino]phenyl]amino]-2-oxidanylidene-ethyl]-4-oxidanylidene-phthalazine-1-carboxylate

Systemtic Name: 3-[2-[[4-[ethyl(propan-2-yl)amino]phenyl]amino]-2-oxidanylidene-ethyl]-4-oxidanylidene-phthalazine-1-carboxylate Openeye Name: 3-[2-[4-[ethyl(isopropyl)amino]anilino]-2-oxo-ethyl]-4-oxo-phthalazine-1-carboxylate CAS Name: 3-[2-[4-[ethyl(propan-2-yl)amino]anilino]-2-oxoethyl]-4-oxo-1-phthalazinecarboxylate IUPAC Name: 3-[2-[4-[ethyl(propan-2-yl)amino]anilino]-2-oxoethyl]-4-oxophthalazine-1-carboxylate Traditional Name: 3-[2-[4-[ethyl(isopropyl)amino]anilino]-2-keto-ethyl]-4-keto-phthalazine-1-carboxylate Formula: C22H23N4O4- MolecularWeight: 407.44242

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=C(C=C1)NC(=O)CN2C(=O)C3=CC=CC=C3C(=N2)C(=O)[O-])C(C)C

Isomeric SMILES

CCN(C1=CC=C(C=C1)NC(=O)CN2C(=O)C3=CC=CC=C3C(=N2)C(=O)[O-])C(C)C

InChI

InChI=1S/C22H24N4O4/c1-4-25(14(2)3)16-11-9-15(10-12-16)23-19(27)13-26-21(28)18-8-6-5-7-17(18)20(24-26)22(29)30/h5-12,14H,4,13H2,1-3H3,(H,23,27)(H,29,30)/p-1