methyl 2-[4-[[4-[(2-methylphenyl)carbamoyl]phenyl]amino]phthalazin-1-yl]ethanoate

Systemtic Name: methyl 2-[4-[[4-[(2-methylphenyl)carbamoyl]phenyl]amino]phthalazin-1-yl]ethanoate Openeye Name: methyl 2-[4-[4-(o-tolylcarbamoyl)anilino]phthalazin-1-yl]acetate CAS Name: 2-[4-[4-[(2-methylanilino)-oxomethyl]anilino]-1-phthalazinyl]acetic acid methyl ester IUPAC Name: methyl 2-[4-[4-[(2-methylphenyl)carbamoyl]anilino]phthalazin-1-yl]acetate Traditional Name: 2-[4-[4-(o-tolylcarbamoyl)anilino]phthalazin-1-yl]acetic acid methyl ester Formula: C25H22N4O3 MolecularWeight: 426.46718

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)C2=CC=C(C=C2)NC3=NN=C(C4=CC=CC=C43)CC(=O)OC

Isomeric SMILES

CC1=CC=CC=C1NC(=O)C2=CC=C(C=C2)NC3=NN=C(C4=CC=CC=C43)CC(=O)OC

InChI

InChI=1S/C25H22N4O3/c1-16-7-3-6-10-21(16)27-25(31)17-11-13-18(14-12-17)26-24-20-9-5-4-8-19(20)22(28-29-24)15-23(30)32-2/h3-14H,15H2,1-2H3,(H,26,29)(H,27,31)