3-[4-[3-(4-nitrophenoxy)-3-phenyl-propyl]piperazin-1-yl]-1,2-benzoxazole

Systemtic Name: 3-[4-[3-(4-nitrophenoxy)-3-phenyl-propyl]piperazin-1-yl]-1,2-benzoxazole Openeye Name: 3-[4-[3-(4-nitrophenoxy)-3-phenyl-propyl]piperazin-1-yl]-1,2-benzoxazole CAS Name: 3-[4-[3-(4-nitrophenoxy)-3-phenylpropyl]-1-piperazinyl]-1,2-benzoxazole IUPAC Name: 3-[4-[3-(4-nitrophenoxy)-3-phenylpropyl]piperazin-1-yl]-1,2-benzoxazole Traditional Name: 3-[4-[3-(4-nitrophenoxy)-3-phenyl-propyl]piperazino]indoxazene Formula: C26H26N4O4 MolecularWeight: 458.50904

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC(C2=CC=CC=C2)OC3=CC=C(C=C3)[N+](=O)[O-])C4=NOC5=CC=CC=C54

Isomeric SMILES

C1CN(CCN1CCC(C2=CC=CC=C2)OC3=CC=C(C=C3)[N+](=O)[O-])C4=NOC5=CC=CC=C54

InChI

InChI=1S/C26H26N4O4/c31-30(32)21-10-12-22(13-11-21)33-24(20-6-2-1-3-7-20)14-15-28-16-18-29(19-17-28)26-23-8-4-5-9-25(23)34-27-26/h1-13,24H,14-19H2