methyl 2-(4-bromophenyl)-5-[4-[(4-chlorophenyl)methyl]piperidin-1-yl]-2-propan-2-yl-pentanoate

Systemtic Name: methyl 2-(4-bromophenyl)-5-[4-[(4-chlorophenyl)methyl]piperidin-1-yl]-2-propan-2-yl-pentanoate Openeye Name: methyl 2-(4-bromophenyl)-5-[4-[(4-chlorophenyl)methyl]-1-piperidyl]-2-isopropyl-pentanoate CAS Name: 2-(4-bromophenyl)-5-[4-[(4-chlorophenyl)methyl]-1-piperidinyl]-2-propan-2-ylpentanoic acid methyl ester IUPAC Name: methyl 2-(4-bromophenyl)-5-[4-[(4-chlorophenyl)methyl]piperidin-1-yl]-2-propan-2-ylpentanoate Traditional Name: 2-(4-bromophenyl)-5-[4-(4-chlorobenzyl)piperidino]-2-isopropyl-valeric acid methyl ester Formula: C27H35BrClNO2 MolecularWeight: 520.9293

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CCCN1CCC(CC1)CC2=CC=C(C=C2)Cl)(C3=CC=C(C=C3)Br)C(=O)OC

Isomeric SMILES

CC(C)C(CCCN1CCC(CC1)CC2=CC=C(C=C2)Cl)(C3=CC=C(C=C3)Br)C(=O)OC

InChI

InChI=1S/C27H35BrClNO2/c1-20(2)27(26(31)32-3,23-7-9-24(28)10-8-23)15-4-16-30-17-13-22(14-18-30)19-21-5-11-25(29)12-6-21/h5-12,20,22H,4,13-19H2,1-3H3