1-(2,3-dihydro-1-benzofuran-5-ylmethyl)-4-[(1R)-1-(3-nitrophenyl)ethyl]piperazine

Systemtic Name: 1-(2,3-dihydro-1-benzofuran-5-ylmethyl)-4-[(1R)-1-(3-nitrophenyl)ethyl]piperazine Openeye Name: 1-(2,3-dihydrobenzofuran-5-ylmethyl)-4-[(1R)-1-(3-nitrophenyl)ethyl]piperazine CAS Name: 1-(2,3-dihydrobenzofuran-5-ylmethyl)-4-[(1R)-1-(3-nitrophenyl)ethyl]piperazine IUPAC Name: 1-(2,3-dihydro-1-benzofuran-5-ylmethyl)-4-[(1R)-1-(3-nitrophenyl)ethyl]piperazine Traditional Name: 1-(coumaran-5-ylmethyl)-4-[(1R)-1-(3-nitrophenyl)ethyl]piperazine Formula: C21H25N3O3 MolecularWeight: 367.4415

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=CC=C1)[N+](=O)[O-])N2CCN(CC2)CC3=CC4=C(C=C3)OCC4

Isomeric SMILES

C[C@H](C1=CC(=CC=C1)[N+](=O)[O-])N2CCN(CC2)CC3=CC4=C(C=C3)OCC4

InChI

InChI=1S/C21H25N3O3/c1-16(18-3-2-4-20(14-18)24(25)26)23-10-8-22(9-11-23)15-17-5-6-21-19(13-17)7-12-27-21/h2-6,13-14,16H,7-12,15H2,1H3/t16-/m1/s1