2-[5-(aminomethyl)-2-methoxy-phenoxy]-1-[4-(pyridin-3-ylmethyl)piperazin-1-yl]ethanone

Systemtic Name: 2-[5-(aminomethyl)-2-methoxy-phenoxy]-1-[4-(pyridin-3-ylmethyl)piperazin-1-yl]ethanone Openeye Name: 2-[5-(aminomethyl)-2-methoxy-phenoxy]-1-[4-(3-pyridylmethyl)piperazin-1-yl]ethanone CAS Name: 2-[5-(aminomethyl)-2-methoxyphenoxy]-1-[4-(3-pyridinylmethyl)-1-piperazinyl]ethanone IUPAC Name: 2-[5-(aminomethyl)-2-methoxyphenoxy]-1-[4-(pyridin-3-ylmethyl)piperazin-1-yl]ethanone Traditional Name: 2-[5-(aminomethyl)-2-methoxy-phenoxy]-1-[4-(3-pyridylmethyl)piperazino]ethanone Formula: C20H26N4O3 MolecularWeight: 370.44544

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H26N4O3/c1-26-18-5-4-16(12-21)11-19(18)27-15-20(25)24-9-7-23(8-10-24)14-17-3-2-6-22-13-17/h2-6,11,13H,7-10,12,14-15,21H2,1H3