6-(1,4-dioxa-8-azaspiro[4.5]decan-8-ylsulfonyl)-4-oxidanylidene-1H-quinoline-3-carboxylate

Systemtic Name: 6-(1,4-dioxa-8-azaspiro[4.5]decan-8-ylsulfonyl)-4-oxidanylidene-1H-quinoline-3-carboxylate Openeye Name: 6-(1,4-dioxa-8-azaspiro[4.5]decan-8-ylsulfonyl)-4-oxo-1H-quinoline-3-carboxylate CAS Name: 6-(1,4-dioxa-8-azaspiro[4.5]decan-8-ylsulfonyl)-4-oxo-1H-quinoline-3-carboxylate IUPAC Name: 6-(1,4-dioxa-8-azaspiro[4.5]decan-8-ylsulfonyl)-4-oxo-1H-quinoline-3-carboxylate Traditional Name: 6-(1,4-dioxa-8-azaspiro[4.5]decan-8-ylsulfonyl)-4-keto-1H-quinoline-3-carboxylate Formula: C17H17N2O7S- MolecularWeight: 393.39108

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC12OCCO2)S(=O)(=O)C3=CC4=C(C=C3)NC=C(C4=O)C(=O)[O-]

Isomeric SMILES

C1CN(CCC12OCCO2)S(=O)(=O)C3=CC4=C(C=C3)NC=C(C4=O)C(=O)[O-]

InChI

InChI=1S/C17H18N2O7S/c20-15-12-9-11(1-2-14(12)18-10-13(15)16(21)22)27(23,24)19-5-3-17(4-6-19)25-7-8-26-17/h1-2,9-10H,3-8H2,(H,18,20)(H,21,22)/p-1