4-(4-oxidanylidenespiro[3H-chromene-2,4'-piperidine]-1'-yl)sulfonylbenzoate

Systemtic Name: 4-(4-oxidanylidenespiro[3H-chromene-2,4'-piperidine]-1'-yl)sulfonylbenzoate Openeye Name: 4-(4-oxospiro[chromane-2,4'-piperidine]-1'-yl)sulfonylbenzoate CAS Name: 4-[(4-oxo-1'-spiro[3,4-dihydro-2H-1-benzopyran-2,4'-piperidine]yl)sulfonyl]benzoate IUPAC Name: 4-(4-oxospiro[3H-chromene-2,4'-piperidine]-1'-yl)sulfonylbenzoate Traditional Name: 4-(4-ketospiro[chroman-2,4'-piperidine]-1'-yl)sulfonylbenzoate Formula: C20H18NO6S- MolecularWeight: 400.42502

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC12CC(=O)C3=CC=CC=C3O2)S(=O)(=O)C4=CC=C(C=C4)C(=O)[O-]

Isomeric SMILES

C1CN(CCC12CC(=O)C3=CC=CC=C3O2)S(=O)(=O)C4=CC=C(C=C4)C(=O)[O-]

InChI

InChI=1S/C20H19NO6S/c22-17-13-20(27-18-4-2-1-3-16(17)18)9-11-21(12-10-20)28(25,26)15-7-5-14(6-8-15)19(23)24/h1-8H,9-13H2,(H,23,24)/p-1