methyl 4-chloranyl-2-[4-(2-methoxycarbonyl-3-oxidanylidene-heptyl)phenyl]benzoate

Systemtic Name: methyl 4-chloranyl-2-[4-(2-methoxycarbonyl-3-oxidanylidene-heptyl)phenyl]benzoate Openeye Name: methyl 4-chloro-2-[4-(2-methoxycarbonyl-3-oxo-heptyl)phenyl]benzoate CAS Name: 4-chloro-2-[4-(2-methoxycarbonyl-3-oxoheptyl)phenyl]benzoic acid methyl ester IUPAC Name: methyl 4-chloro-2-[4-(2-methoxycarbonyl-3-oxoheptyl)phenyl]benzoate Traditional Name: 2-[4-(2-carbomethoxy-3-keto-heptyl)phenyl]-4-chloro-benzoic acid methyl ester Formula: C23H25ClO5 MolecularWeight: 416.8946

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H25ClO5/c1-4-5-6-21(25)20(23(27)29-3)13-15-7-9-16(10-8-15)19-14-17(24)11-12-18(19)22(26)28-2/h7-12,14,20H,4-6,13H2,1-3H3