tert-butyl 2-[4-(2-methoxycarbonyl-3-oxidanylidene-heptyl)phenyl]benzoate

Systemtic Name: tert-butyl 2-[4-(2-methoxycarbonyl-3-oxidanylidene-heptyl)phenyl]benzoate Openeye Name: tert-butyl 2-[4-(2-methoxycarbonyl-3-oxo-heptyl)phenyl]benzoate CAS Name: 2-[4-(2-methoxycarbonyl-3-oxoheptyl)phenyl]benzoic acid tert-butyl ester IUPAC Name: tert-butyl 2-[4-(2-methoxycarbonyl-3-oxoheptyl)phenyl]benzoate Traditional Name: 2-[4-(2-carbomethoxy-3-keto-heptyl)phenyl]benzoic acid tert-butyl ester Formula: C26H32O5 MolecularWeight: 424.52928

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)C(CC1=CC=C(C=C1)C2=CC=CC=C2C(=O)OC(C)(C)C)C(=O)OC

Isomeric SMILES

CCCCC(=O)C(CC1=CC=C(C=C1)C2=CC=CC=C2C(=O)OC(C)(C)C)C(=O)OC

InChI

InChI=1S/C26H32O5/c1-6-7-12-23(27)22(24(28)30-5)17-18-13-15-19(16-14-18)20-10-8-9-11-21(20)25(29)31-26(2,3)4/h8-11,13-16,22H,6-7,12,17H2,1-5H3