[(3R,4R)-1-(phenylmethyl)-4-piperazin-1-yl-pyrrolidin-3-yl] ethanoate

Systemtic Name: [(3R,4R)-1-(phenylmethyl)-4-piperazin-1-yl-pyrrolidin-3-yl] ethanoate Openeye Name: [(3R,4R)-1-benzyl-4-piperazin-1-yl-pyrrolidin-3-yl] acetate CAS Name: acetic acid [(3R,4R)-1-(phenylmethyl)-4-(1-piperazinyl)-3-pyrrolidinyl] ester IUPAC Name: [(3R,4R)-1-benzyl-4-piperazin-1-ylpyrrolidin-3-yl] acetate Traditional Name: acetic acid [(3R,4R)-1-benzyl-4-piperazino-pyrrolidin-3-yl] ester Formula: C17H25N3O2 MolecularWeight: 303.3993

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1CN(CC1N2CCNCC2)CC3=CC=CC=C3

Isomeric SMILES

CC(=O)O[C@@H]1CN(C[C@H]1N2CCNCC2)CC3=CC=CC=C3

InChI

InChI=1S/C17H25N3O2/c1-14(21)22-17-13-19(11-15-5-3-2-4-6-15)12-16(17)20-9-7-18-8-10-20/h2-6,16-18H,7-13H2,1H3/t16-,17-/m1/s1