1-(diethoxymethyl)-4-methoxy-benzene; (E)-2-methylbut-2-enoate; 3-phenylpropanal

Systemtic Name: 1-(diethoxymethyl)-4-methoxy-benzene; (E)-2-methylbut-2-enoate; 3-phenylpropanal Openeye Name: 1-(diethoxymethyl)-4-methoxy-benzene; (E)-2-methylbut-2-enoate; 3-phenylpropanal CAS Name: 1-(diethoxymethyl)-4-methoxybenzene; (E)-2-methyl-2-butenoate; 3-phenylpropanal IUPAC Name: 1-(diethoxymethyl)-4-methoxybenzene; (E)-2-methylbut-2-enoate; 3-phenylpropanal Traditional Name: 1-(diethoxymethyl)-4-methoxy-benzene; (E)-2-methylbut-2-enoate; 3-phenylpropionaldehyde Formula: C26H35O6- MolecularWeight: 443.5525

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(C1=CC=C(C=C1)OC)OCC.CC=C(C)C(=O)[O-].C1=CC=C(C=C1)CCC=O

Isomeric SMILES

CCOC(C1=CC=C(C=C1)OC)OCC.C/C=C(\C)/C(=O)[O-].C1=CC=C(C=C1)CCC=O

InChI

InChI=1S/C12H18O3.C9H10O.C5H8O2/c1-4-14-12(15-5-2)10-6-8-11(13-3)9-7-10;10-8-4-7-9-5-2-1-3-6-9;1-3-4(2)5(6)7/h6-9,12H,4-5H2,1-3H3;1-3,5-6,8H,4,7H2;3H,1-2H3,(H,6,7)/p-1/b;;4-3+