2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl 2-[(4-bromophenyl)sulfonylamino]-3-oxidanyl-propanoate

Systemtic Name: 2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl 2-[(4-bromophenyl)sulfonylamino]-3-oxidanyl-propanoate Openeye Name: 2-(1,3-dioxoisoindolin-2-yl)ethyl 2-[(4-bromophenyl)sulfonylamino]-3-hydroxy-propanoate CAS Name: 2-[(4-bromophenyl)sulfonylamino]-3-hydroxypropanoic acid 2-(1,3-dioxo-2-isoindolyl)ethyl ester IUPAC Name: 2-(1,3-dioxoisoindol-2-yl)ethyl 2-[(4-bromophenyl)sulfonylamino]-3-hydroxypropanoate Traditional Name: 2-(brosylamino)-3-hydroxy-propionic acid 2-phthalimidoethyl ester Formula: C19H17BrN2O7S MolecularWeight: 497.31648

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CCOC(=O)C(CO)NS(=O)(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CCOC(=O)C(CO)NS(=O)(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C19H17BrN2O7S/c20-12-5-7-13(8-6-12)30(27,28)21-16(11-23)19(26)29-10-9-22-17(24)14-3-1-2-4-15(14)18(22)25/h1-8,16,21,23H,9-11H2