1-bromanyl-4-[(E,3Z,4S,5R,6S)-3-ethylidene-5-methoxy-4,6-dimethyl-7-phenylmethoxy-hept-1-enyl]benzene

Systemtic Name: 1-bromanyl-4-[(E,3Z,4S,5R,6S)-3-ethylidene-5-methoxy-4,6-dimethyl-7-phenylmethoxy-hept-1-enyl]benzene Openeye Name: 1-[(E,3Z,4S,5R,6S)-7-benzyloxy-3-ethylidene-5-methoxy-4,6-dimethyl-hept-1-enyl]-4-bromo-benzene CAS Name: 1-bromo-4-[(E,3Z,4S,5R,6S)-3-ethylidene-5-methoxy-4,6-dimethyl-7-phenylmethoxyhept-1-enyl]benzene IUPAC Name: 1-bromo-4-[(E,3Z,4S,5R,6S)-3-ethylidene-5-methoxy-4,6-dimethyl-7-phenylmethoxyhept-1-enyl]benzene Traditional Name: 1-[(1E,3Z)-3-[(1S,2R,3S)-4-benzoxy-2-methoxy-1,3-dimethyl-butyl]penta-1,3-dienyl]-4-bromo-benzene Formula: C25H31BrO2 MolecularWeight: 443.41644

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Descriptors Computed from Structure

Canonical SMILES:

CC=C(C=CC1=CC=C(C=C1)Br)C(C)C(C(C)COCC2=CC=CC=C2)OC

Isomeric SMILES

C/C=C(/C=C/C1=CC=C(C=C1)Br)\[C@H](C)[C@H]([C@@H](C)COCC2=CC=CC=C2)OC

InChI

InChI=1S/C25H31BrO2/c1-5-23(14-11-21-12-15-24(26)16-13-21)20(3)25(27-4)19(2)17-28-18-22-9-7-6-8-10-22/h5-16,19-20,25H,17-18H2,1-4H3/b14-11+,23-5-/t19-,20-,25-/m0/s1