4-prop-2-ynoxybutan-2-yl 2-(3-chloranyl-4-ethoxy-phenyl)-3-methyl-butanoate

Systemtic Name: 4-prop-2-ynoxybutan-2-yl 2-(3-chloranyl-4-ethoxy-phenyl)-3-methyl-butanoate Openeye Name: (1-methyl-3-prop-2-ynoxy-propyl) 2-(3-chloro-4-ethoxy-phenyl)-3-methyl-butanoate CAS Name: 2-(3-chloro-4-ethoxyphenyl)-3-methylbutanoic acid 4-prop-2-ynoxybutan-2-yl ester IUPAC Name: 4-prop-2-ynoxybutan-2-yl 2-(3-chloro-4-ethoxyphenyl)-3-methylbutanoate Traditional Name: 2-(3-chloro-4-ethoxy-phenyl)-3-methyl-butyric acid (1-methyl-3-propargyloxy-propyl) ester Formula: C20H27ClO4 MolecularWeight: 366.87898

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(C(C)C)C(=O)OC(C)CCOCC#C)Cl

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(C(C)C)C(=O)OC(C)CCOCC#C)Cl

InChI

InChI=1S/C20H27ClO4/c1-6-11-23-12-10-15(5)25-20(22)19(14(3)4)16-8-9-18(24-7-2)17(21)13-16/h1,8-9,13-15,19H,7,10-12H2,2-5H3