2-[5-(aminomethyl)-2-methoxy-phenoxy]-1-[4-[(4-aminophenyl)methyl]piperazin-1-yl]ethanone

Systemtic Name: 2-[5-(aminomethyl)-2-methoxy-phenoxy]-1-[4-[(4-aminophenyl)methyl]piperazin-1-yl]ethanone Openeye Name: 2-[5-(aminomethyl)-2-methoxy-phenoxy]-1-[4-[(4-aminophenyl)methyl]piperazin-1-yl]ethanone CAS Name: 2-[5-(aminomethyl)-2-methoxyphenoxy]-1-[4-[(4-aminophenyl)methyl]-1-piperazinyl]ethanone IUPAC Name: 2-[5-(aminomethyl)-2-methoxyphenoxy]-1-[4-[(4-aminophenyl)methyl]piperazin-1-yl]ethanone Traditional Name: 1-[4-(4-aminobenzyl)piperazino]-2-[5-(aminomethyl)-2-methoxy-phenoxy]ethanone Formula: C21H28N4O3 MolecularWeight: 384.47202

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN)OCC(=O)N2CCN(CC2)CC3=CC=C(C=C3)N

Isomeric SMILES

COC1=C(C=C(C=C1)CN)OCC(=O)N2CCN(CC2)CC3=CC=C(C=C3)N

InChI

InChI=1S/C21H28N4O3/c1-27-19-7-4-17(13-22)12-20(19)28-15-21(26)25-10-8-24(9-11-25)14-16-2-5-18(23)6-3-16/h2-7,12H,8-11,13-15,22-23H2,1H3