methyl 3-[[4-(acridin-9-ylamino)phenyl]sulfamoyl]propanoate

Systemtic Name: methyl 3-[[4-(acridin-9-ylamino)phenyl]sulfamoyl]propanoate Openeye Name: methyl 3-[[4-(acridin-9-ylamino)phenyl]sulfamoyl]propanoate CAS Name: 3-[[4-(9-acridinylamino)phenyl]sulfamoyl]propanoic acid methyl ester IUPAC Name: methyl 3-[[4-(acridin-9-ylamino)phenyl]sulfamoyl]propanoate Traditional Name: 3-[[4-(acridin-9-ylamino)phenyl]sulfamoyl]propionic acid methyl ester Formula: C23H21N3O4S MolecularWeight: 435.49554

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCS(=O)(=O)NC1=CC=C(C=C1)NC2=C3C=CC=CC3=NC4=CC=CC=C42

Isomeric SMILES

COC(=O)CCS(=O)(=O)NC1=CC=C(C=C1)NC2=C3C=CC=CC3=NC4=CC=CC=C42

InChI

InChI=1S/C23H21N3O4S/c1-30-22(27)14-15-31(28,29)26-17-12-10-16(11-13-17)24-23-18-6-2-4-8-20(18)25-21-9-5-3-7-19(21)23/h2-13,26H,14-15H2,1H3,(H,24,25)