ethyl 4-[4-[(3-methylphenyl)amino]phthalazin-1-yl]benzoate

Systemtic Name: ethyl 4-[4-[(3-methylphenyl)amino]phthalazin-1-yl]benzoate Openeye Name: ethyl 4-[4-(3-methylanilino)phthalazin-1-yl]benzoate CAS Name: 4-[4-(3-methylanilino)-1-phthalazinyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[4-(3-methylanilino)phthalazin-1-yl]benzoate Traditional Name: 4-[4-(m-toluidino)phthalazin-1-yl]benzoic acid ethyl ester Formula: C24H21N3O2 MolecularWeight: 383.44244

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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=CC(=C4)C

Isomeric SMILES

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

InChI

InChI=1S/C24H21N3O2/c1-3-29-24(28)18-13-11-17(12-14-18)22-20-9-4-5-10-21(20)23(27-26-22)25-19-8-6-7-16(2)15-19/h4-15H,3H2,1-2H3,(H,25,27)