ethyl 2-[4-[(4-sulfamoylphenyl)amino]phthalazin-1-yl]ethanoate

Systemtic Name: ethyl 2-[4-[(4-sulfamoylphenyl)amino]phthalazin-1-yl]ethanoate Openeye Name: ethyl 2-[4-(4-sulfamoylanilino)phthalazin-1-yl]acetate CAS Name: 2-[4-(4-sulfamoylanilino)-1-phthalazinyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-(4-sulfamoylanilino)phthalazin-1-yl]acetate Traditional Name: 2-[4-(4-sulfamoylanilino)phthalazin-1-yl]acetic acid ethyl ester Formula: C18H18N4O4S MolecularWeight: 386.42492

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=NN=C(C2=CC=CC=C21)NC3=CC=C(C=C3)S(=O)(=O)N

Isomeric SMILES

CCOC(=O)CC1=NN=C(C2=CC=CC=C21)NC3=CC=C(C=C3)S(=O)(=O)N

InChI

InChI=1S/C18H18N4O4S/c1-2-26-17(23)11-16-14-5-3-4-6-15(14)18(22-21-16)20-12-7-9-13(10-8-12)27(19,24)25/h3-10H,2,11H2,1H3,(H,20,22)(H2,19,24,25)