3-[2-[[2-[(4-chlorophenyl)methylamino]-2-oxidanylidene-ethyl]-ethyl-amino]-2-oxidanylidene-ethyl]-4-oxidanylidene-phthalazine-1-carboxylate

Systemtic Name: 3-[2-[[2-[(4-chlorophenyl)methylamino]-2-oxidanylidene-ethyl]-ethyl-amino]-2-oxidanylidene-ethyl]-4-oxidanylidene-phthalazine-1-carboxylate Openeye Name: 3-[2-[[2-[(4-chlorophenyl)methylamino]-2-oxo-ethyl]-ethyl-amino]-2-oxo-ethyl]-4-oxo-phthalazine-1-carboxylate CAS Name: 3-[2-[[2-[(4-chlorophenyl)methylamino]-2-oxoethyl]-ethylamino]-2-oxoethyl]-4-oxo-1-phthalazinecarboxylate IUPAC Name: 3-[2-[[2-[(4-chlorophenyl)methylamino]-2-oxoethyl]-ethylamino]-2-oxoethyl]-4-oxophthalazine-1-carboxylate Traditional Name: 3-[2-[[2-[(4-chlorobenzyl)amino]-2-keto-ethyl]-ethyl-amino]-2-keto-ethyl]-4-keto-phthalazine-1-carboxylate Formula: C22H20ClN4O5- MolecularWeight: 455.871

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(=O)NCC1=CC=C(C=C1)Cl)C(=O)CN2C(=O)C3=CC=CC=C3C(=N2)C(=O)[O-]

Isomeric SMILES

CCN(CC(=O)NCC1=CC=C(C=C1)Cl)C(=O)CN2C(=O)C3=CC=CC=C3C(=N2)C(=O)[O-]

InChI

InChI=1S/C22H21ClN4O5/c1-2-26(12-18(28)24-11-14-7-9-15(23)10-8-14)19(29)13-27-21(30)17-6-4-3-5-16(17)20(25-27)22(31)32/h3-10H,2,11-13H2,1H3,(H,24,28)(H,31,32)/p-1