sodium [4-(3-phenoxypropyl)phenyl] 2-chloranylpropanoate

Systemtic Name: sodium [4-(3-phenoxypropyl)phenyl] 2-chloranylpropanoate Openeye Name: sodium [4-(3-phenoxypropyl)phenyl] 2-chloropropanoate CAS Name: sodium 2-chloropropanoic acid [4-(3-phenoxypropyl)phenyl] ester IUPAC Name: sodium [4-(3-phenoxypropyl)phenyl] 2-chloropropanoate Traditional Name: sodium 2-chloropropionic acid [4-(3-phenoxypropyl)phenyl] ester Formula: C18H19ClNaO3+ MolecularWeight: 341.78443

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC1=CC=C(C=C1)CCCOC2=CC=CC=C2)Cl.[Na+]

Isomeric SMILES

CC(C(=O)OC1=CC=C(C=C1)CCCOC2=CC=CC=C2)Cl.[Na+]

InChI

InChI=1S/C18H19ClO3.Na/c1-14(19)18(20)22-17-11-9-15(10-12-17)6-5-13-21-16-7-3-2-4-8-16;/h2-4,7-12,14H,5-6,13H2,1H3;/q;+1