2-[4-(2-azanylethyl)-2-methoxy-phenoxy]-1-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]ethanone

Systemtic Name: 2-[4-(2-azanylethyl)-2-methoxy-phenoxy]-1-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]ethanone Openeye Name: 2-[4-(2-aminoethyl)-2-methoxy-phenoxy]-1-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]ethanone CAS Name: 2-[4-(2-aminoethyl)-2-methoxyphenoxy]-1-[4-[(4-chlorophenyl)methyl]-1-piperazinyl]ethanone IUPAC Name: 2-[4-(2-aminoethyl)-2-methoxyphenoxy]-1-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]ethanone Traditional Name: 2-[4-(2-aminoethyl)-2-methoxy-phenoxy]-1-[4-(4-chlorobenzyl)piperazino]ethanone Formula: C22H28ClN3O3 MolecularWeight: 417.92902

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H28ClN3O3/c1-28-21-14-17(8-9-24)4-7-20(21)29-16-22(27)26-12-10-25(11-13-26)15-18-2-5-19(23)6-3-18/h2-7,14H,8-13,15-16,24H2,1H3