[3-carboxy-1-chloranyl-7-methoxy-4,7-bis(oxidanylidene)heptyl]-trimethyl-azanium

Systemtic Name: [3-carboxy-1-chloranyl-7-methoxy-4,7-bis(oxidanylidene)heptyl]-trimethyl-azanium Openeye Name: (3-carboxy-1-chloro-7-methoxy-4,7-dioxo-heptyl)-trimethyl-ammonium CAS Name: (3-carboxy-1-chloro-7-methoxy-4,7-dioxoheptyl)-trimethylammonium IUPAC Name: (3-carboxy-1-chloro-7-methoxy-4,7-dioxoheptyl)-trimethylazanium Traditional Name: (3-carboxy-1-chloro-4,7-diketo-7-methoxy-heptyl)-trimethyl-ammonium Formula: C12H21ClNO5+ MolecularWeight: 294.75184

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)C(CC(C(=O)CCC(=O)OC)C(=O)O)Cl

Isomeric SMILES

C[N+](C)(C)C(CC(C(=O)CCC(=O)OC)C(=O)O)Cl

InChI

InChI=1S/C12H20ClNO5/c1-14(2,3)10(13)7-8(12(17)18)9(15)5-6-11(16)19-4/h8,10H,5-7H2,1-4H3/p+1