5-methoxy-6-phenylmethoxy-2,3-dihydro-1H-indol-1-ium; 2-oxidanyl-2-oxidanylidene-ethanoate

Systemtic Name: 5-methoxy-6-phenylmethoxy-2,3-dihydro-1H-indol-1-ium; 2-oxidanyl-2-oxidanylidene-ethanoate Openeye Name: 6-benzyloxy-5-methoxy-indolin-1-ium; 2-hydroxy-2-oxo-acetate CAS Name: 2-hydroxy-2-oxoacetate; 5-methoxy-6-phenylmethoxy-2,3-dihydro-1H-indol-1-ium IUPAC Name: 2-hydroxy-2-oxoacetate; 5-methoxy-6-phenylmethoxy-2,3-dihydro-1H-indol-1-ium Traditional Name: 6-benzoxy-5-methoxy-indolin-1-ium binoxalate Formula: C18H19NO6 MolecularWeight: 345.34656

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)CC[NH2+]2)OCC3=CC=CC=C3.C(=O)(C(=O)[O-])O

Isomeric SMILES

COC1=C(C=C2C(=C1)CC[NH2+]2)OCC3=CC=CC=C3.C(=O)(C(=O)[O-])O

InChI

InChI=1S/C16H17NO2.C2H2O4/c1-18-15-9-13-7-8-17-14(13)10-16(15)19-11-12-5-3-2-4-6-12;3-1(4)2(5)6/h2-6,9-10,17H,7-8,11H2,1H3;(H,3,4)(H,5,6)