methyl 2-(4-bromophenyl)-5-[4-[(3-chlorophenyl)methyl]piperidin-1-yl]-2-propan-2-yl-pentanoate

Systemtic Name: methyl 2-(4-bromophenyl)-5-[4-[(3-chlorophenyl)methyl]piperidin-1-yl]-2-propan-2-yl-pentanoate Openeye Name: methyl 2-(4-bromophenyl)-5-[4-[(3-chlorophenyl)methyl]-1-piperidyl]-2-isopropyl-pentanoate CAS Name: 2-(4-bromophenyl)-5-[4-[(3-chlorophenyl)methyl]-1-piperidinyl]-2-propan-2-ylpentanoic acid methyl ester IUPAC Name: methyl 2-(4-bromophenyl)-5-[4-[(3-chlorophenyl)methyl]piperidin-1-yl]-2-propan-2-ylpentanoate Traditional Name: 2-(4-bromophenyl)-5-[4-(3-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(=CC=C2)Cl)(C3=CC=C(C=C3)Br)C(=O)OC

Isomeric SMILES

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

InChI

InChI=1S/C27H35BrClNO2/c1-20(2)27(26(31)32-3,23-8-10-24(28)11-9-23)14-5-15-30-16-12-21(13-17-30)18-22-6-4-7-25(29)19-22/h4,6-11,19-21H,5,12-18H2,1-3H3