3-[4-[3-[(3-bromanyl-4-methoxy-phenyl)methyl-(furan-2-ylmethyl)amino]propyl]piperazin-1-yl]propan-1-amine

Systemtic Name: 3-[4-[3-[(3-bromanyl-4-methoxy-phenyl)methyl-(furan-2-ylmethyl)amino]propyl]piperazin-1-yl]propan-1-amine Openeye Name: 3-[4-[3-[(3-bromo-4-methoxy-phenyl)methyl-(2-furylmethyl)amino]propyl]piperazin-1-yl]propan-1-amine CAS Name: 3-[4-[3-[(3-bromo-4-methoxyphenyl)methyl-(2-furanylmethyl)amino]propyl]-1-piperazinyl]-1-propanamine IUPAC Name: 3-[4-[3-[(3-bromo-4-methoxyphenyl)methyl-(furan-2-ylmethyl)amino]propyl]piperazin-1-yl]propan-1-amine Traditional Name: 3-[4-(3-aminopropyl)piperazino]propyl-(3-bromo-4-methoxy-benzyl)-(2-furfuryl)amine Formula: C23H35BrN4O2 MolecularWeight: 479.4536

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN(CCCN2CCN(CC2)CCCN)CC3=CC=CO3)Br

Isomeric SMILES

COC1=C(C=C(C=C1)CN(CCCN2CCN(CC2)CCCN)CC3=CC=CO3)Br

InChI

InChI=1S/C23H35BrN4O2/c1-29-23-7-6-20(17-22(23)24)18-28(19-21-5-2-16-30-21)11-4-10-27-14-12-26(13-15-27)9-3-8-25/h2,5-7,16-17H,3-4,8-15,18-19,25H2,1H3