[(3R,4S)-4-methyl-1-oxidanylidene-hexan-3-yl] 4-methoxybenzoate

Systemtic Name: [(3R,4S)-4-methyl-1-oxidanylidene-hexan-3-yl] 4-methoxybenzoate Openeye Name: [(1R,2S)-2-methyl-1-(2-oxoethyl)butyl] 4-methoxybenzoate CAS Name: 4-methoxybenzoic acid [(3R,4S)-4-methyl-1-oxohexan-3-yl] ester IUPAC Name: [(3R,4S)-4-methyl-1-oxohexan-3-yl] 4-methoxybenzoate Traditional Name: 4-methoxybenzoic acid [(1R,2S)-1-(2-ketoethyl)-2-methyl-butyl] ester Formula: C15H20O4 MolecularWeight: 264.3169

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(CC=O)OC(=O)C1=CC=C(C=C1)OC

Isomeric SMILES

CC[C@H](C)[C@@H](CC=O)OC(=O)C1=CC=C(C=C1)OC

InChI

InChI=1S/C15H20O4/c1-4-11(2)14(9-10-16)19-15(17)12-5-7-13(18-3)8-6-12/h5-8,10-11,14H,4,9H2,1-3H3/t11-,14+/m0/s1