3-[2-[[5-chloranyl-2-(4-ethoxyphenoxy)phenyl]amino]-2-oxidanylidene-ethyl]-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: 3-[2-[[5-chloranyl-2-(4-ethoxyphenoxy)phenyl]amino]-2-oxidanylidene-ethyl]-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: 3-[2-[5-chloro-2-(4-ethoxyphenoxy)anilino]-2-oxo-ethyl]-4-oxo-phthalazine-1-carboxamide CAS Name: 3-[2-[5-chloro-2-(4-ethoxyphenoxy)anilino]-2-oxoethyl]-4-oxo-1-phthalazinecarboxamide IUPAC Name: 3-[2-[5-chloro-2-(4-ethoxyphenoxy)anilino]-2-oxoethyl]-4-oxophthalazine-1-carboxamide Traditional Name: 3-[2-[5-chloro-2-(4-ethoxyphenoxy)anilino]-2-keto-ethyl]-4-keto-phthalazine-1-carboxamide Formula: C25H21ClN4O5 MolecularWeight: 492.91104

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)OC2=C(C=C(C=C2)Cl)NC(=O)CN3C(=O)C4=CC=CC=C4C(=N3)C(=O)N

Isomeric SMILES

CCOC1=CC=C(C=C1)OC2=C(C=C(C=C2)Cl)NC(=O)CN3C(=O)C4=CC=CC=C4C(=N3)C(=O)N

InChI

InChI=1S/C25H21ClN4O5/c1-2-34-16-8-10-17(11-9-16)35-21-12-7-15(26)13-20(21)28-22(31)14-30-25(33)19-6-4-3-5-18(19)23(29-30)24(27)32/h3-13H,2,14H2,1H3,(H2,27,32)(H,28,31)