methyl 2-[3-[2-[(3,4-dimethylphenyl)amino]-2-oxidanylidene-ethyl]-4-oxidanylidene-phthalazin-1-yl]ethanoate

Systemtic Name: methyl 2-[3-[2-[(3,4-dimethylphenyl)amino]-2-oxidanylidene-ethyl]-4-oxidanylidene-phthalazin-1-yl]ethanoate Openeye Name: methyl 2-[3-[2-(3,4-dimethylanilino)-2-oxo-ethyl]-4-oxo-phthalazin-1-yl]acetate CAS Name: 2-[3-[2-(3,4-dimethylanilino)-2-oxoethyl]-4-oxo-1-phthalazinyl]acetic acid methyl ester IUPAC Name: methyl 2-[3-[2-(3,4-dimethylanilino)-2-oxoethyl]-4-oxophthalazin-1-yl]acetate Traditional Name: 2-[3-[2-(3,4-dimethylanilino)-2-keto-ethyl]-4-keto-phthalazin-1-yl]acetic acid methyl ester Formula: C21H21N3O4 MolecularWeight: 379.40914

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CN2C(=O)C3=CC=CC=C3C(=N2)CC(=O)OC)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CN2C(=O)C3=CC=CC=C3C(=N2)CC(=O)OC)C

InChI

InChI=1S/C21H21N3O4/c1-13-8-9-15(10-14(13)2)22-19(25)12-24-21(27)17-7-5-4-6-16(17)18(23-24)11-20(26)28-3/h4-10H,11-12H2,1-3H3,(H,22,25)