2-[(5-bromanyl-2,4-dimethoxy-phenyl)methyl]-4-(diphenylmethyl)-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazine

Systemtic Name: 2-[(5-bromanyl-2,4-dimethoxy-phenyl)methyl]-4-(diphenylmethyl)-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazine Openeye Name: 4-benzhydryl-2-[(5-bromo-2,4-dimethoxy-phenyl)methyl]-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazine CAS Name: 2-[(5-bromo-2,4-dimethoxyphenyl)methyl]-4-(diphenylmethyl)-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazine IUPAC Name: 4-benzhydryl-2-[(5-bromo-2,4-dimethoxyphenyl)methyl]-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazine Traditional Name: 4-benzhydryl-2-(5-bromo-2,4-dimethoxy-benzyl)-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazine Formula: C29H33BrN2O2 MolecularWeight: 521.48852

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1CN2CC3CCCN3C(C2)C(C4=CC=CC=C4)C5=CC=CC=C5)Br)OC

Isomeric SMILES

COC1=CC(=C(C=C1CN2CC3CCCN3C(C2)C(C4=CC=CC=C4)C5=CC=CC=C5)Br)OC

InChI

InChI=1S/C29H33BrN2O2/c1-33-27-17-28(34-2)25(30)16-23(27)18-31-19-24-14-9-15-32(24)26(20-31)29(21-10-5-3-6-11-21)22-12-7-4-8-13-22/h3-8,10-13,16-17,24,26,29H,9,14-15,18-20H2,1-2H3