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

Systemtic Name: methyl 2-(4-bromophenyl)-5-[4-[(3-methoxyphenyl)methyl]piperidin-1-yl]-2-propan-2-yl-pentanoate Openeye Name: methyl 2-(4-bromophenyl)-2-isopropyl-5-[4-[(3-methoxyphenyl)methyl]-1-piperidyl]pentanoate CAS Name: 2-(4-bromophenyl)-5-[4-[(3-methoxyphenyl)methyl]-1-piperidinyl]-2-propan-2-ylpentanoic acid methyl ester IUPAC Name: methyl 2-(4-bromophenyl)-5-[4-[(3-methoxyphenyl)methyl]piperidin-1-yl]-2-propan-2-ylpentanoate Traditional Name: 2-(4-bromophenyl)-2-isopropyl-5-(4-m-anisylpiperidino)valeric acid methyl ester Formula: C28H38BrNO3 MolecularWeight: 516.51022

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H38BrNO3/c1-21(2)28(27(31)33-4,24-9-11-25(29)12-10-24)15-6-16-30-17-13-22(14-18-30)19-23-7-5-8-26(20-23)32-3/h5,7-12,20-22H,6,13-19H2,1-4H3