ethyl 2-[(3S)-3-(methylaminomethyl)-4-(phenylmethyl)piperazin-1-yl]ethanoate

Systemtic Name: ethyl 2-[(3S)-3-(methylaminomethyl)-4-(phenylmethyl)piperazin-1-yl]ethanoate Openeye Name: ethyl 2-[(3S)-4-benzyl-3-(methylaminomethyl)piperazin-1-yl]acetate CAS Name: 2-[(3S)-3-(methylaminomethyl)-4-(phenylmethyl)-1-piperazinyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[(3S)-4-benzyl-3-(methylaminomethyl)piperazin-1-yl]acetate Traditional Name: 2-[(3S)-4-benzyl-3-(methylaminomethyl)piperazino]acetic acid ethyl ester Formula: C17H27N3O2 MolecularWeight: 305.41518

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1CCN(C(C1)CNC)CC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)CN1CCN([C@H](C1)CNC)CC2=CC=CC=C2

InChI

InChI=1S/C17H27N3O2/c1-3-22-17(21)14-19-9-10-20(16(13-19)11-18-2)12-15-7-5-4-6-8-15/h4-8,16,18H,3,9-14H2,1-2H3/t16-/m0/s1