7-nitro-1-[2-oxidanyl-3-(4-phenylphenoxy)propyl]-3-pyrrolidin-1-yl-quinoxalin-2-one

Systemtic Name: 7-nitro-1-[2-oxidanyl-3-(4-phenylphenoxy)propyl]-3-pyrrolidin-1-yl-quinoxalin-2-one Openeye Name: 1-[2-hydroxy-3-(4-phenylphenoxy)propyl]-7-nitro-3-pyrrolidin-1-yl-quinoxalin-2-one CAS Name: 1-[2-hydroxy-3-(4-phenylphenoxy)propyl]-7-nitro-3-(1-pyrrolidinyl)-2-quinoxalinone IUPAC Name: 1-[2-hydroxy-3-(4-phenylphenoxy)propyl]-7-nitro-3-pyrrolidin-1-ylquinoxalin-2-one Traditional Name: 1-[2-hydroxy-3-(4-phenylphenoxy)propyl]-7-nitro-3-pyrrolidino-quinoxalin-2-one Formula: C27H26N4O5 MolecularWeight: 486.51914

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=NC3=C(C=C(C=C3)[N+](=O)[O-])N(C2=O)CC(COC4=CC=C(C=C4)C5=CC=CC=C5)O

Isomeric SMILES

C1CCN(C1)C2=NC3=C(C=C(C=C3)[N+](=O)[O-])N(C2=O)CC(COC4=CC=C(C=C4)C5=CC=CC=C5)O

InChI

InChI=1S/C27H26N4O5/c32-22(18-36-23-11-8-20(9-12-23)19-6-2-1-3-7-19)17-30-25-16-21(31(34)35)10-13-24(25)28-26(27(30)33)29-14-4-5-15-29/h1-3,6-13,16,22,32H,4-5,14-15,17-18H2