methyl 2-[4-[[4-(4-chlorophenyl)phthalazin-1-yl]amino]phenoxy]ethanoate

Systemtic Name: methyl 2-[4-[[4-(4-chlorophenyl)phthalazin-1-yl]amino]phenoxy]ethanoate Openeye Name: methyl 2-[4-[[4-(4-chlorophenyl)phthalazin-1-yl]amino]phenoxy]acetate CAS Name: 2-[4-[[4-(4-chlorophenyl)-1-phthalazinyl]amino]phenoxy]acetic acid methyl ester IUPAC Name: methyl 2-[4-[[4-(4-chlorophenyl)phthalazin-1-yl]amino]phenoxy]acetate Traditional Name: 2-[4-[[4-(4-chlorophenyl)phthalazin-1-yl]amino]phenoxy]acetic acid methyl ester Formula: C23H18ClN3O3 MolecularWeight: 419.86032

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)COC1=CC=C(C=C1)NC2=NN=C(C3=CC=CC=C32)C4=CC=C(C=C4)Cl

Isomeric SMILES

COC(=O)COC1=CC=C(C=C1)NC2=NN=C(C3=CC=CC=C32)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C23H18ClN3O3/c1-29-21(28)14-30-18-12-10-17(11-13-18)25-23-20-5-3-2-4-19(20)22(26-27-23)15-6-8-16(24)9-7-15/h2-13H,14H2,1H3,(H,25,27)