ethyl (2S,3R)-3-(4-chlorophenyl)-2-methyl-2-(4-propan-2-ylphenoxy)pentanoate

Systemtic Name: ethyl (2S,3R)-3-(4-chlorophenyl)-2-methyl-2-(4-propan-2-ylphenoxy)pentanoate Openeye Name: ethyl (2S,3R)-3-(4-chlorophenyl)-2-(4-isopropylphenoxy)-2-methyl-pentanoate CAS Name: (2S,3R)-3-(4-chlorophenyl)-2-methyl-2-(4-propan-2-ylphenoxy)pentanoic acid ethyl ester IUPAC Name: ethyl (2S,3R)-3-(4-chlorophenyl)-2-methyl-2-(4-propan-2-ylphenoxy)pentanoate Traditional Name: (2S,3R)-3-(4-chlorophenyl)-2-(4-isopropylphenoxy)-2-methyl-valeric acid ethyl ester Formula: C23H29ClO3 MolecularWeight: 388.92756

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=C(C=C1)Cl)C(C)(C(=O)OCC)OC2=CC=C(C=C2)C(C)C

Isomeric SMILES

CC[C@H](C1=CC=C(C=C1)Cl)[C@@](C)(C(=O)OCC)OC2=CC=C(C=C2)C(C)C

InChI

InChI=1S/C23H29ClO3/c1-6-21(18-8-12-19(24)13-9-18)23(5,22(25)26-7-2)27-20-14-10-17(11-15-20)16(3)4/h8-16,21H,6-7H2,1-5H3/t21-,23+/m1/s1