(E)-3-phenylprop-2-enoate; tetrabutylazanium

Systemtic Name: (E)-3-phenylprop-2-enoate; tetrabutylazanium Openeye Name: (E)-3-phenylprop-2-enoate; tetrabutylammonium CAS Name: (E)-3-phenyl-2-propenoate; tetrabutylammonium IUPAC Name: (E)-3-phenylprop-2-enoate; tetrabutylazanium Traditional Name: (E)-3-phenylacrylate; tetrabutylammonium Formula: C25H43NO2 MolecularWeight: 389.61442

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[N+](CCCC)(CCCC)CCCC.C1=CC=C(C=C1)C=CC(=O)[O-]

Isomeric SMILES

CCCC[N+](CCCC)(CCCC)CCCC.C1=CC=C(C=C1)/C=C/C(=O)[O-]

InChI

InChI=1S/C16H36N.C9H8O2/c1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4;10-9(11)7-6-8-4-2-1-3-5-8/h5-16H2,1-4H3;1-7H,(H,10,11)/q+1;/p-1/b;7-6+