ethyl 7-bromanyl-2-(3,4-dimethoxyphenyl)carbonyl-heptanoate

Systemtic Name: ethyl 7-bromanyl-2-(3,4-dimethoxyphenyl)carbonyl-heptanoate Openeye Name: ethyl 7-bromo-2-(3,4-dimethoxybenzoyl)heptanoate CAS Name: 7-bromo-2-[(3,4-dimethoxyphenyl)-oxomethyl]heptanoic acid ethyl ester IUPAC Name: ethyl 7-bromo-2-(3,4-dimethoxybenzoyl)heptanoate Traditional Name: 7-bromo-2-veratroyl-enanthic acid ethyl ester Formula: C18H25BrO5 MolecularWeight: 401.2921

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCCCCBr)C(=O)C1=CC(=C(C=C1)OC)OC

Isomeric SMILES

CCOC(=O)C(CCCCCBr)C(=O)C1=CC(=C(C=C1)OC)OC

InChI

InChI=1S/C18H25BrO5/c1-4-24-18(21)14(8-6-5-7-11-19)17(20)13-9-10-15(22-2)16(12-13)23-3/h9-10,12,14H,4-8,11H2,1-3H3