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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H38BrNO3/c1-21(2)28(27(31)33-4,24-8-10-25(29)11-9-24)16-5-17-30-18-14-23(15-19-30)20-22-6-12-26(32-3)13-7-22/h6-13,21,23H,5,14-20H2,1-4H3