3-[2,6-bis(chloranyl)phenyl]-5-[3,4-bis(oxidanyl)butyl]-N-[4-(diethylamino)phenyl]-1,2-oxazole-4-carboxamide

Systemtic Name: 3-[2,6-bis(chloranyl)phenyl]-5-[3,4-bis(oxidanyl)butyl]-N-[4-(diethylamino)phenyl]-1,2-oxazole-4-carboxamide Openeye Name: 3-(2,6-dichlorophenyl)-N-[4-(diethylamino)phenyl]-5-(3,4-dihydroxybutyl)isoxazole-4-carboxamide CAS Name: 3-(2,6-dichlorophenyl)-N-[4-(diethylamino)phenyl]-5-(3,4-dihydroxybutyl)-4-isoxazolecarboxamide IUPAC Name: 3-(2,6-dichlorophenyl)-N-[4-(diethylamino)phenyl]-5-(3,4-dihydroxybutyl)-1,2-oxazole-4-carboxamide Traditional Name: 3-(2,6-dichlorophenyl)-N-[4-(diethylamino)phenyl]-5-(3,4-dihydroxybutyl)isoxazole-4-carboxamide Formula: C24H27Cl2N3O4 MolecularWeight: 492.39488

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC=C(C=C1)NC(=O)C2=C(ON=C2C3=C(C=CC=C3Cl)Cl)CCC(CO)O

Isomeric SMILES

CCN(CC)C1=CC=C(C=C1)NC(=O)C2=C(ON=C2C3=C(C=CC=C3Cl)Cl)CCC(CO)O

InChI

InChI=1S/C24H27Cl2N3O4/c1-3-29(4-2)16-10-8-15(9-11-16)27-24(32)22-20(13-12-17(31)14-30)33-28-23(22)21-18(25)6-5-7-19(21)26/h5-11,17,30-31H,3-4,12-14H2,1-2H3,(H,27,32)