[(2E,7E,11E)-10-methoxy-1-(3-methoxyphenyl)-3,7,9,11-tetramethyl-6-(phenylsulfonyl)trideca-2,7,11-trien-5-yl] benzoate

Systemtic Name: [(2E,7E,11E)-10-methoxy-1-(3-methoxyphenyl)-3,7,9,11-tetramethyl-6-(phenylsulfonyl)trideca-2,7,11-trien-5-yl] benzoate Openeye Name: [(3E,7E)-2-(benzenesulfonyl)-6-methoxy-1-[(E)-4-(3-methoxyphenyl)-2-methyl-but-2-enyl]-3,5,7-trimethyl-nona-3,7-dienyl] benzoate CAS Name: benzoic acid [(2E,7E,11E)-6-(benzenesulfonyl)-10-methoxy-1-(3-methoxyphenyl)-3,7,9,11-tetramethyltrideca-2,7,11-trien-5-yl] ester IUPAC Name: [(2E,7E,11E)-6-(benzenesulfonyl)-10-methoxy-1-(3-methoxyphenyl)-3,7,9,11-tetramethyltrideca-2,7,11-trien-5-yl] benzoate Traditional Name: benzoic acid [(3E,7E)-2-besyl-6-methoxy-1-[(E)-4-(3-methoxyphenyl)-2-methyl-but-2-enyl]-3,5,7-trimethyl-nona-3,7-dienyl] ester Formula: C38H46O6S MolecularWeight: 630.83324

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC=C(C)C(C(C)C=C(C)C(C(CC(=CCC1=CC(=CC=C1)OC)C)OC(=O)C2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3)OC

Isomeric SMILES

C/C=C(\C)/C(C(C)/C=C(\C)/C(C(C/C(=C/CC1=CC(=CC=C1)OC)/C)OC(=O)C2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3)OC

InChI

InChI=1S/C38H46O6S/c1-8-28(3)36(43-7)29(4)25-30(5)37(45(40,41)34-20-13-10-14-21-34)35(44-38(39)32-17-11-9-12-18-32)24-27(2)22-23-31-16-15-19-33(26-31)42-6/h8-22,25-26,29,35-37H,23-24H2,1-7H3/b27-22+,28-8+,30-25+