(3-phenoxyphenyl)methyl 2-(4-chlorophenyl)-2-propan-2-yl-pent-3-ynoate

Systemtic Name: (3-phenoxyphenyl)methyl 2-(4-chlorophenyl)-2-propan-2-yl-pent-3-ynoate Openeye Name: (3-phenoxyphenyl)methyl 2-(4-chlorophenyl)-2-isopropyl-pent-3-ynoate CAS Name: 2-(4-chlorophenyl)-2-propan-2-yl-3-pentynoic acid (3-phenoxyphenyl)methyl ester IUPAC Name: (3-phenoxyphenyl)methyl 2-(4-chlorophenyl)-2-propan-2-ylpent-3-ynoate Traditional Name: 2-(4-chlorophenyl)-2-isopropyl-pent-3-ynoic acid (3-phenoxybenzyl) ester Formula: C27H25ClO3 MolecularWeight: 432.9386

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Descriptors Computed from Structure

Canonical SMILES:

CC#CC(C1=CC=C(C=C1)Cl)(C(C)C)C(=O)OCC2=CC(=CC=C2)OC3=CC=CC=C3

Isomeric SMILES

CC#CC(C1=CC=C(C=C1)Cl)(C(C)C)C(=O)OCC2=CC(=CC=C2)OC3=CC=CC=C3

InChI

InChI=1S/C27H25ClO3/c1-4-17-27(20(2)3,22-13-15-23(28)16-14-22)26(29)30-19-21-9-8-12-25(18-21)31-24-10-6-5-7-11-24/h5-16,18,20H,19H2,1-3H3