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

Systemtic Name: 3-[2-[[2-[(4-chlorophenyl)methylamino]-2-oxidanylidene-ethyl]-ethyl-amino]-2-oxidanylidene-ethyl]-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: 3-[2-[[2-[(4-chlorophenyl)methylamino]-2-oxo-ethyl]-ethyl-amino]-2-oxo-ethyl]-4-oxo-phthalazine-1-carboxamide CAS Name: 3-[2-[[2-[(4-chlorophenyl)methylamino]-2-oxoethyl]-ethylamino]-2-oxoethyl]-4-oxo-1-phthalazinecarboxamide IUPAC Name: 3-[2-[[2-[(4-chlorophenyl)methylamino]-2-oxoethyl]-ethylamino]-2-oxoethyl]-4-oxophthalazine-1-carboxamide Traditional Name: 3-[2-[[2-[(4-chlorobenzyl)amino]-2-keto-ethyl]-ethyl-amino]-2-keto-ethyl]-4-keto-phthalazine-1-carboxamide Formula: C22H22ClN5O4 MolecularWeight: 455.89418

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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)N

Isomeric SMILES

CCN(CC(=O)NCC1=CC=C(C=C1)Cl)C(=O)CN2C(=O)C3=CC=CC=C3C(=N2)C(=O)N

InChI

InChI=1S/C22H22ClN5O4/c1-2-27(12-18(29)25-11-14-7-9-15(23)10-8-14)19(30)13-28-22(32)17-6-4-3-5-16(17)20(26-28)21(24)31/h3-10H,2,11-13H2,1H3,(H2,24,31)(H,25,29)