ethyl 2-[4-[(2,4-dimethylphenyl)amino]phthalazin-1-yl]ethanoate

Systemtic Name: ethyl 2-[4-[(2,4-dimethylphenyl)amino]phthalazin-1-yl]ethanoate Openeye Name: ethyl 2-[4-(2,4-dimethylanilino)phthalazin-1-yl]acetate CAS Name: 2-[4-(2,4-dimethylanilino)-1-phthalazinyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-(2,4-dimethylanilino)phthalazin-1-yl]acetate Traditional Name: 2-[4-(2,4-dimethylanilino)phthalazin-1-yl]acetic acid ethyl ester Formula: C20H21N3O2 MolecularWeight: 335.39964

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=NN=C(C2=CC=CC=C21)NC3=C(C=C(C=C3)C)C

Isomeric SMILES

CCOC(=O)CC1=NN=C(C2=CC=CC=C21)NC3=C(C=C(C=C3)C)C

InChI

InChI=1S/C20H21N3O2/c1-4-25-19(24)12-18-15-7-5-6-8-16(15)20(23-22-18)21-17-10-9-13(2)11-14(17)3/h5-11H,4,12H2,1-3H3,(H,21,23)