[(3S,5S)-5-[(4-methoxyphenyl)methoxy]-2-methyl-hex-1-en-3-yl] (2S)-2-ethylbut-3-enoate

Systemtic Name: [(3S,5S)-5-[(4-methoxyphenyl)methoxy]-2-methyl-hex-1-en-3-yl] (2S)-2-ethylbut-3-enoate Openeye Name: [(1S,3S)-1-isopropenyl-3-[(4-methoxyphenyl)methoxy]butyl] (2S)-2-ethylbut-3-enoate CAS Name: (2S)-2-ethyl-3-butenoic acid [(3S,5S)-5-[(4-methoxyphenyl)methoxy]-2-methylhex-1-en-3-yl] ester IUPAC Name: [(3S,5S)-5-[(4-methoxyphenyl)methoxy]-2-methylhex-1-en-3-yl] (2S)-2-ethylbut-3-enoate Traditional Name: (2S)-2-ethylbut-3-enoic acid [(1S)-2-methyl-1-[(2S)-2-p-anisyloxypropyl]allyl] ester Formula: C21H30O4 MolecularWeight: 346.4605

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H30O4/c1-7-18(8-2)21(22)25-20(15(3)4)13-16(5)24-14-17-9-11-19(23-6)12-10-17/h7,9-12,16,18,20H,1,3,8,13-14H2,2,4-6H3/t16-,18+,20-/m0/s1