propyl 4-[4-[(4-methoxycarbonylphenyl)amino]phthalazin-1-yl]benzoate

Systemtic Name: propyl 4-[4-[(4-methoxycarbonylphenyl)amino]phthalazin-1-yl]benzoate Openeye Name: propyl 4-[4-(4-methoxycarbonylanilino)phthalazin-1-yl]benzoate CAS Name: 4-[4-(4-methoxycarbonylanilino)-1-phthalazinyl]benzoic acid propyl ester IUPAC Name: propyl 4-[4-(4-methoxycarbonylanilino)phthalazin-1-yl]benzoate Traditional Name: 4-[4-(4-carbomethoxyanilino)phthalazin-1-yl]benzoic acid propyl ester Formula: C26H23N3O4 MolecularWeight: 441.47852

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H23N3O4/c1-3-16-33-26(31)19-10-8-17(9-11-19)23-21-6-4-5-7-22(21)24(29-28-23)27-20-14-12-18(13-15-20)25(30)32-2/h4-15H,3,16H2,1-2H3,(H,27,29)