(phenylmethyl) 2-[(1S,2S,3R)-2-butanoyl-3-propyl-cyclopropyl]ethanoate

Systemtic Name: (phenylmethyl) 2-[(1S,2S,3R)-2-butanoyl-3-propyl-cyclopropyl]ethanoate Openeye Name: benzyl 2-[(1S,2S,3R)-2-butanoyl-3-propyl-cyclopropyl]acetate CAS Name: 2-[(1S,2S,3R)-2-(1-oxobutyl)-3-propylcyclopropyl]acetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[(1S,2S,3R)-2-butanoyl-3-propylcyclopropyl]acetate Traditional Name: 2-[(1S,2S,3R)-2-butyryl-3-propyl-cyclopropyl]acetic acid benzyl ester Formula: C19H26O3 MolecularWeight: 302.40794

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1C(C1C(=O)CCC)CC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CCC[C@@H]1[C@@H]([C@H]1C(=O)CCC)CC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C19H26O3/c1-3-8-15-16(19(15)17(20)9-4-2)12-18(21)22-13-14-10-6-5-7-11-14/h5-7,10-11,15-16,19H,3-4,8-9,12-13H2,1-2H3/t15-,16+,19+/m1/s1