[4-(3-bromanyl-5-methoxy-phenyl)-1-[(3,4-dimethoxyphenyl)methyl]piperazin-2-yl]methanamine

Systemtic Name: [4-(3-bromanyl-5-methoxy-phenyl)-1-[(3,4-dimethoxyphenyl)methyl]piperazin-2-yl]methanamine Openeye Name: [4-(3-bromo-5-methoxy-phenyl)-1-[(3,4-dimethoxyphenyl)methyl]piperazin-2-yl]methanamine CAS Name: [4-(3-bromo-5-methoxyphenyl)-1-[(3,4-dimethoxyphenyl)methyl]-2-piperazinyl]methanamine IUPAC Name: [4-(3-bromo-5-methoxyphenyl)-1-[(3,4-dimethoxyphenyl)methyl]piperazin-2-yl]methanamine Traditional Name: [4-(3-bromo-5-methoxy-phenyl)-1-veratryl-piperazin-2-yl]methylamine Formula: C21H28BrN3O3 MolecularWeight: 450.36932

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN2CCN(CC2CN)C3=CC(=CC(=C3)Br)OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CN2CCN(CC2CN)C3=CC(=CC(=C3)Br)OC)OC

InChI

InChI=1S/C21H28BrN3O3/c1-26-19-10-16(22)9-17(11-19)25-7-6-24(18(12-23)14-25)13-15-4-5-20(27-2)21(8-15)28-3/h4-5,8-11,18H,6-7,12-14,23H2,1-3H3