2-ethoxyaniline; 1,3,2$l^{2}-dioxastibolane-4,5-dicarboxylic acid; hydrate

Systemtic Name: 2-ethoxyaniline; 1,3,2$l^{2}-dioxastibolane-4,5-dicarboxylic acid; hydrate Openeye Name: 2-ethoxyaniline; 1,3,2$l^{2}-dioxastibolane-4,5-dicarboxylic acid; hydrate CAS Name: 2-ethoxyaniline; 1,3,2$l^{2}-dioxastibolane-4,5-dicarboxylic acid; hydrate IUPAC Name: 2-ethoxyaniline; 1,3,2$l^{2}-dioxastibolane-4,5-dicarboxylic acid; hydrate Traditional Name: 1,3,2$l^{2}-dioxantimonolane-4,5-dicarboxylic acid; o-phenetidine; hydrate Formula: C12H17NO8Sb MolecularWeight: 425.02528

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N.C1(C(O[Sb]O1)C(=O)O)C(=O)O.O

Isomeric SMILES

CCOC1=CC=CC=C1N.C1(C(O[Sb]O1)C(=O)O)C(=O)O.O

InChI

InChI=1S/C8H11NO.C4H4O6.H2O.Sb/c1-2-10-8-6-4-3-5-7(8)9;5-1(3(7)8)2(6)4(9)10;;/h3-6H,2,9H2,1H3;1-2H,(H,7,8)(H,9,10);1H2;/q;-2;;+2