5-(3-methyl-4-propan-2-yl-phenoxy)pentanoate

Systemtic Name: 5-(3-methyl-4-propan-2-yl-phenoxy)pentanoate Openeye Name: 5-(4-isopropyl-3-methyl-phenoxy)pentanoate CAS Name: 5-(3-methyl-4-propan-2-ylphenoxy)pentanoate IUPAC Name: 5-(3-methyl-4-propan-2-ylphenoxy)pentanoate Traditional Name: 5-(4-isopropyl-3-methyl-phenoxy)valerate Formula: C15H21O3- MolecularWeight: 249.32544

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCCCCC(=O)[O-])C(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)OCCCCC(=O)[O-])C(C)C

InChI

InChI=1S/C15H22O3/c1-11(2)14-8-7-13(10-12(14)3)18-9-5-4-6-15(16)17/h7-8,10-11H,4-6,9H2,1-3H3,(H,16,17)/p-1