1-[4-(2-ethoxyphenyl)piperazin-1-yl]-3-(4-nitrophenoxy)propan-2-ol

Systemtic Name: 1-[4-(2-ethoxyphenyl)piperazin-1-yl]-3-(4-nitrophenoxy)propan-2-ol Openeye Name: 1-[4-(2-ethoxyphenyl)piperazin-1-yl]-3-(4-nitrophenoxy)propan-2-ol CAS Name: 1-[4-(2-ethoxyphenyl)-1-piperazinyl]-3-(4-nitrophenoxy)-2-propanol IUPAC Name: 1-[4-(2-ethoxyphenyl)piperazin-1-yl]-3-(4-nitrophenoxy)propan-2-ol Traditional Name: 1-(4-nitrophenoxy)-3-(4-o-phenetylpiperazino)propan-2-ol Formula: C21H27N3O5 MolecularWeight: 401.45618

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N2CCN(CC2)CC(COC3=CC=C(C=C3)[N+](=O)[O-])O

Isomeric SMILES

CCOC1=CC=CC=C1N2CCN(CC2)CC(COC3=CC=C(C=C3)[N+](=O)[O-])O

InChI

InChI=1S/C21H27N3O5/c1-2-28-21-6-4-3-5-20(21)23-13-11-22(12-14-23)15-18(25)16-29-19-9-7-17(8-10-19)24(26)27/h3-10,18,25H,2,11-16H2,1H3