[(2Z,4S,5S)-7-(chloromethyl)-4-methyl-5-phenylmethoxy-octa-2,7-dien-3-yl] ethanoate

Systemtic Name: [(2Z,4S,5S)-7-(chloromethyl)-4-methyl-5-phenylmethoxy-octa-2,7-dien-3-yl] ethanoate Openeye Name: [(1Z,2S,3S)-3-benzyloxy-5-(chloromethyl)-1-ethylidene-2-methyl-hex-5-enyl] acetate CAS Name: acetic acid [(2Z,4S,5S)-7-(chloromethyl)-4-methyl-5-phenylmethoxyocta-2,7-dien-3-yl] ester IUPAC Name: [(2Z,4S,5S)-7-(chloromethyl)-4-methyl-5-phenylmethoxyocta-2,7-dien-3-yl] acetate Traditional Name: acetic acid [(1Z,2S,3S)-3-benzoxy-5-(chloromethyl)-1-ethylidene-2-methyl-hex-5-enyl] ester Formula: C19H25ClO3 MolecularWeight: 336.853

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Descriptors Computed from Structure

Canonical SMILES:

CC=C(C(C)C(CC(=C)CCl)OCC1=CC=CC=C1)OC(=O)C

Isomeric SMILES

C/C=C(/[C@@H](C)[C@H](CC(=C)CCl)OCC1=CC=CC=C1)\OC(=O)C

InChI

InChI=1S/C19H25ClO3/c1-5-18(23-16(4)21)15(3)19(11-14(2)12-20)22-13-17-9-7-6-8-10-17/h5-10,15,19H,2,11-13H2,1,3-4H3/b18-5-/t15-,19+/m1/s1