phenethyl 4-[(4-morpholin-4-ylsulfonylphenyl)amino]-4-oxidanylidene-butanoate

Systemtic Name: phenethyl 4-[(4-morpholin-4-ylsulfonylphenyl)amino]-4-oxidanylidene-butanoate Openeye Name: phenethyl 4-(4-morpholinosulfonylanilino)-4-oxo-butanoate CAS Name: 4-[4-(4-morpholinylsulfonyl)anilino]-4-oxobutanoic acid phenethyl ester IUPAC Name: phenethyl 4-(4-morpholin-4-ylsulfonylanilino)-4-oxobutanoate Traditional Name: 4-keto-4-(4-morpholinosulfonylanilino)butyric acid phenethyl ester Formula: C22H26N2O6S MolecularWeight: 446.51664

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)NC(=O)CCC(=O)OCCC3=CC=CC=C3

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)NC(=O)CCC(=O)OCCC3=CC=CC=C3

InChI

InChI=1S/C22H26N2O6S/c25-21(10-11-22(26)30-15-12-18-4-2-1-3-5-18)23-19-6-8-20(9-7-19)31(27,28)24-13-16-29-17-14-24/h1-9H,10-17H2,(H,23,25)