3-azanyl-2,5-diethoxy-hexane-1,2,3,4,5,6-hexacarboxylic acid

Systemtic Name: 3-azanyl-2,5-diethoxy-hexane-1,2,3,4,5,6-hexacarboxylic acid Openeye Name: 3-amino-2,5-diethoxy-hexane-1,2,3,4,5,6-hexacarboxylic acid CAS Name: 3-amino-2,5-diethoxyhexane-1,2,3,4,5,6-hexacarboxylic acid IUPAC Name: 3-amino-2,5-diethoxyhexane-1,2,3,4,5,6-hexacarboxylic acid Traditional Name: 3-amino-2,5-diethoxy-hexane-1,2,3,4,5,6-hexacarboxylic acid Formula: C16H23NO14 MolecularWeight: 453.35212

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(CC(=O)O)(C(C(=O)O)C(C(=O)O)(C(CC(=O)O)(C(=O)O)OCC)N)C(=O)O

Isomeric SMILES

CCOC(CC(=O)O)(C(C(=O)O)C(C(=O)O)(C(CC(=O)O)(C(=O)O)OCC)N)C(=O)O

InChI

InChI=1S/C16H23NO14/c1-3-30-14(11(24)25,5-7(18)19)9(10(22)23)16(17,13(28)29)15(12(26)27,31-4-2)6-8(20)21/h9H,3-6,17H2,1-2H3,(H,18,19)(H,20,21)(H,22,23)(H,24,25)(H,26,27)(H,28,29)