(3S,4S)-7-methoxy-2,2-dimethyl-3-phenyl-4-(4-prop-2-enoxyphenyl)-3,4-dihydrochromene

Systemtic Name: (3S,4S)-7-methoxy-2,2-dimethyl-3-phenyl-4-(4-prop-2-enoxyphenyl)-3,4-dihydrochromene Openeye Name: (3S,4S)-4-(4-allyloxyphenyl)-7-methoxy-2,2-dimethyl-3-phenyl-chromane CAS Name: (3S,4S)-7-methoxy-2,2-dimethyl-3-phenyl-4-(4-prop-2-enoxyphenyl)-3,4-dihydro-2H-1-benzopyran IUPAC Name: (3S,4S)-7-methoxy-2,2-dimethyl-3-phenyl-4-(4-prop-2-enoxyphenyl)-3,4-dihydrochromene Traditional Name: (3S,4S)-4-(4-allyloxyphenyl)-7-methoxy-2,2-dimethyl-3-phenyl-chroman Formula: C27H28O3 MolecularWeight: 400.50942

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C2=C(O1)C=C(C=C2)OC)C3=CC=C(C=C3)OCC=C)C4=CC=CC=C4)C

Isomeric SMILES

CC1([C@@H]([C@H](C2=C(O1)C=C(C=C2)OC)C3=CC=C(C=C3)OCC=C)C4=CC=CC=C4)C

InChI

InChI=1S/C27H28O3/c1-5-17-29-21-13-11-19(12-14-21)25-23-16-15-22(28-4)18-24(23)30-27(2,3)26(25)20-9-7-6-8-10-20/h5-16,18,25-26H,1,17H2,2-4H3/t25-,26+/m0/s1