dimethyl 5-[(2E,4Z)-4-methoxycarbonyl-5-phenethyl-1-phenyl-nona-2,4-dien-3-yl]-4-oxidanyl-2,6-diphenethyl-benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[(2E,4Z)-4-methoxycarbonyl-5-phenethyl-1-phenyl-nona-2,4-dien-3-yl]-4-oxidanyl-2,6-diphenethyl-benzene-1,3-dicarboxylate Openeye Name: dimethyl 4-hydroxy-5-[(Z,1E)-2-methoxycarbonyl-3-phenethyl-1-phenethylidene-hept-2-enyl]-2,6-diphenethyl-benzene-1,3-dicarboxylate CAS Name: 4-hydroxy-5-[(2E,4Z)-4-methoxycarbonyl-5-phenethyl-1-phenylnona-2,4-dien-3-yl]-2,6-diphenethylbenzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 4-hydroxy-5-[(2E,4Z)-4-methoxycarbonyl-5-phenethyl-1-phenylnona-2,4-dien-3-yl]-2,6-diphenethylbenzene-1,3-dicarboxylate Traditional Name: 5-[(Z,1E)-2-carbomethoxy-3-phenethyl-1-phenethylidene-hept-2-enyl]-4-hydroxy-2,6-diphenethyl-benzene-1,3-dicarboxylic acid dimethyl ester Formula: C51H54O7 MolecularWeight: 778.97026

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=C(C(=CCC1=CC=CC=C1)C2=C(C(=C(C(=C2CCC3=CC=CC=C3)C(=O)OC)CCC4=CC=CC=C4)C(=O)OC)O)C(=O)OC)CCC5=CC=CC=C5

Isomeric SMILES

CCCC/C(=C(\C(=C\CC1=CC=CC=C1)\C2=C(C(=C(C(=C2CCC3=CC=CC=C3)C(=O)OC)CCC4=CC=CC=C4)C(=O)OC)O)/C(=O)OC)/CCC5=CC=CC=C5

InChI

InChI=1S/C51H54O7/c1-5-6-27-40(32-28-36-19-11-7-12-20-36)44(49(53)56-2)41(33-29-37-21-13-8-14-22-37)45-42(34-30-38-23-15-9-16-24-38)46(50(54)57-3)43(47(48(45)52)51(55)58-4)35-31-39-25-17-10-18-26-39/h7-26,33,52H,5-6,27-32,34-35H2,1-4H3/b41-33-,44-40-