[4-oxidanylidene-4-[(2,4,6-trimethylphenyl)amino]butyl] 4-methoxy-3-morpholin-4-ylsulfonyl-benzoate

Systemtic Name: [4-oxidanylidene-4-[(2,4,6-trimethylphenyl)amino]butyl] 4-methoxy-3-morpholin-4-ylsulfonyl-benzoate Openeye Name: [4-oxo-4-(2,4,6-trimethylanilino)butyl] 4-methoxy-3-morpholinosulfonyl-benzoate CAS Name: 4-methoxy-3-(4-morpholinylsulfonyl)benzoic acid [4-oxo-4-(2,4,6-trimethylanilino)butyl] ester IUPAC Name: [4-oxo-4-(2,4,6-trimethylanilino)butyl] 4-methoxy-3-morpholin-4-ylsulfonylbenzoate Traditional Name: 4-methoxy-3-morpholinosulfonyl-benzoic acid (4-keto-4-mesidino-butyl) ester Formula: C25H32N2O7S MolecularWeight: 504.59578

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NC(=O)CCCOC(=O)C2=CC(=C(C=C2)OC)S(=O)(=O)N3CCOCC3)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC(=O)CCCOC(=O)C2=CC(=C(C=C2)OC)S(=O)(=O)N3CCOCC3)C

InChI

InChI=1S/C25H32N2O7S/c1-17-14-18(2)24(19(3)15-17)26-23(28)6-5-11-34-25(29)20-7-8-21(32-4)22(16-20)35(30,31)27-9-12-33-13-10-27/h7-8,14-16H,5-6,9-13H2,1-4H3,(H,26,28)