1,1-bis(3-propan-2-yloxypropyl)-2H-pyridin-1-ium-4,6-dicarboxylic acid

Systemtic Name: 1,1-bis(3-propan-2-yloxypropyl)-2H-pyridin-1-ium-4,6-dicarboxylic acid Openeye Name: 1,1-bis(3-isopropoxypropyl)-2H-pyridin-1-ium-4,6-dicarboxylic acid CAS Name: 1,1-bis(3-propan-2-yloxypropyl)-2H-pyridin-1-ium-4,6-dicarboxylic acid IUPAC Name: 1,1-bis(3-propan-2-yloxypropyl)-2H-pyridin-1-ium-4,6-dicarboxylic acid Traditional Name: 1,1-bis(3-isopropoxypropyl)-2H-pyridin-1-ium-4,6-dicarboxylic acid Formula: C19H32NO6+ MolecularWeight: 370.46048

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OCCC[N+]1(CC=C(C=C1C(=O)O)C(=O)O)CCCOC(C)C

Isomeric SMILES

CC(C)OCCC[N+]1(CC=C(C=C1C(=O)O)C(=O)O)CCCOC(C)C

InChI

InChI=1S/C19H31NO6/c1-14(2)25-11-5-8-20(9-6-12-26-15(3)4)10-7-16(18(21)22)13-17(20)19(23)24/h7,13-15H,5-6,8-12H2,1-4H3,(H-,21,22,23,24)/p+1