(E)-4-[(2-ethoxyphenoxy)methoxy]-4-oxidanylidene-but-2-enoic acid; (1-ethylpiperidin-2-yl)methanol

Systemtic Name: (E)-4-[(2-ethoxyphenoxy)methoxy]-4-oxidanylidene-but-2-enoic acid; (1-ethylpiperidin-2-yl)methanol Openeye Name: (E)-4-[(2-ethoxyphenoxy)methoxy]-4-oxo-but-2-enoic acid; (1-ethyl-2-piperidyl)methanol CAS Name: (E)-4-[(2-ethoxyphenoxy)methoxy]-4-oxo-2-butenoic acid; (1-ethyl-2-piperidinyl)methanol IUPAC Name: (E)-4-[(2-ethoxyphenoxy)methoxy]-4-oxobut-2-enoic acid; (1-ethylpiperidin-2-yl)methanol Traditional Name: (E)-4-[(2-ethoxyphenoxy)methoxy]-4-keto-but-2-enoic acid; (1-ethyl-2-piperidyl)methanol Formula: C21H31NO7 MolecularWeight: 409.47334

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCCCC1CO.CCOC1=CC=CC=C1OCOC(=O)C=CC(=O)O

Isomeric SMILES

CCN1CCCCC1CO.CCOC1=CC=CC=C1OCOC(=O)/C=C/C(=O)O

InChI

InChI=1S/C13H14O6.C8H17NO/c1-2-17-10-5-3-4-6-11(10)18-9-19-13(16)8-7-12(14)15;1-2-9-6-4-3-5-8(9)7-10/h3-8H,2,9H2,1H3,(H,14,15);8,10H,2-7H2,1H3/b8-7+;