ethyl 4-[4-[[4-(methylcarbamoyl)phenyl]amino]phthalazin-1-yl]benzoate

Systemtic Name: ethyl 4-[4-[[4-(methylcarbamoyl)phenyl]amino]phthalazin-1-yl]benzoate Openeye Name: ethyl 4-[4-[4-(methylcarbamoyl)anilino]phthalazin-1-yl]benzoate CAS Name: 4-[4-[4-(methylcarbamoyl)anilino]-1-phthalazinyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[4-[4-(methylcarbamoyl)anilino]phthalazin-1-yl]benzoate Traditional Name: 4-[4-[4-(methylcarbamoyl)anilino]phthalazin-1-yl]benzoic acid ethyl ester Formula: C25H22N4O3 MolecularWeight: 426.46718

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)C2=NN=C(C3=CC=CC=C32)NC4=CC=C(C=C4)C(=O)NC

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)C2=NN=C(C3=CC=CC=C32)NC4=CC=C(C=C4)C(=O)NC

InChI

InChI=1S/C25H22N4O3/c1-3-32-25(31)18-10-8-16(9-11-18)22-20-6-4-5-7-21(20)23(29-28-22)27-19-14-12-17(13-15-19)24(30)26-2/h4-15H,3H2,1-2H3,(H,26,30)(H,27,29)