(3-cyano-3,3-diphenyl-propyl) 3-morpholin-4-ylsulfonylbenzoate

Systemtic Name: (3-cyano-3,3-diphenyl-propyl) 3-morpholin-4-ylsulfonylbenzoate Openeye Name: (3-cyano-3,3-diphenyl-propyl) 3-morpholinosulfonylbenzoate CAS Name: 3-(4-morpholinylsulfonyl)benzoic acid (3-cyano-3,3-diphenylpropyl) ester IUPAC Name: (3-cyano-3,3-diphenylpropyl) 3-morpholin-4-ylsulfonylbenzoate Traditional Name: 3-morpholinosulfonylbenzoic acid (3-cyano-3,3-diphenyl-propyl) ester Formula: C27H26N2O5S MolecularWeight: 490.57074

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=CC(=C2)C(=O)OCCC(C#N)(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=CC(=C2)C(=O)OCCC(C#N)(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H26N2O5S/c28-21-27(23-9-3-1-4-10-23,24-11-5-2-6-12-24)14-17-34-26(30)22-8-7-13-25(20-22)35(31,32)29-15-18-33-19-16-29/h1-13,20H,14-19H2