3-[8-(2-carboxyethylcarbamoyl)-6-oxidanylidene-quinolizin-3-yl]oxypropylazanium

Systemtic Name: 3-[8-(2-carboxyethylcarbamoyl)-6-oxidanylidene-quinolizin-3-yl]oxypropylazanium Openeye Name: 3-[8-(2-carboxyethylcarbamoyl)-6-oxo-quinolizin-3-yl]oxypropylammonium CAS Name: 3-[[8-[(2-carboxyethylamino)-oxomethyl]-6-oxo-3-quinolizinyl]oxy]propylammonium IUPAC Name: 3-[8-(2-carboxyethylcarbamoyl)-6-oxoquinolizin-3-yl]oxypropylazanium Traditional Name: 3-[8-(2-carboxyethylcarbamoyl)-6-keto-quinolizin-3-yl]oxypropylammonium Formula: C16H20N3O5+ MolecularWeight: 334.3471

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN2C1=CC(=CC2=O)C(=O)NCCC(=O)O)OCCC[NH3+]

Isomeric SMILES

C1=CC(=CN2C1=CC(=CC2=O)C(=O)NCCC(=O)O)OCCC[NH3+]

InChI

InChI=1S/C16H19N3O5/c17-5-1-7-24-13-3-2-12-8-11(9-14(20)19(12)10-13)16(23)18-6-4-15(21)22/h2-3,8-10H,1,4-7,17H2,(H,18,23)(H,21,22)/p+1