N-(4-bromophenyl)-N-[[3-(3,4,5-trimethoxyphenyl)phenyl]methyl]piperidin-4-amine

Systemtic Name: N-(4-bromophenyl)-N-[[3-(3,4,5-trimethoxyphenyl)phenyl]methyl]piperidin-4-amine Openeye Name: N-(4-bromophenyl)-N-[[3-(3,4,5-trimethoxyphenyl)phenyl]methyl]piperidin-4-amine CAS Name: N-(4-bromophenyl)-N-[[3-(3,4,5-trimethoxyphenyl)phenyl]methyl]-4-piperidinamine IUPAC Name: N-(4-bromophenyl)-N-[[3-(3,4,5-trimethoxyphenyl)phenyl]methyl]piperidin-4-amine Traditional Name: (4-bromophenyl)-(4-piperidyl)-[3-(3,4,5-trimethoxyphenyl)benzyl]amine Formula: C27H31BrN2O3 MolecularWeight: 511.45064

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C2=CC(=CC=C2)CN(C3CCNCC3)C4=CC=C(C=C4)Br

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C2=CC(=CC=C2)CN(C3CCNCC3)C4=CC=C(C=C4)Br

InChI

InChI=1S/C27H31BrN2O3/c1-31-25-16-21(17-26(32-2)27(25)33-3)20-6-4-5-19(15-20)18-30(24-11-13-29-14-12-24)23-9-7-22(28)8-10-23/h4-10,15-17,24,29H,11-14,18H2,1-3H3