1-[3-(2,6-dimethylphenoxy)-2-oxidanyl-propyl]-7-nitro-3-pyrrolidin-1-yl-quinoxalin-2-one

Systemtic Name: 1-[3-(2,6-dimethylphenoxy)-2-oxidanyl-propyl]-7-nitro-3-pyrrolidin-1-yl-quinoxalin-2-one Openeye Name: 1-[3-(2,6-dimethylphenoxy)-2-hydroxy-propyl]-7-nitro-3-pyrrolidin-1-yl-quinoxalin-2-one CAS Name: 1-[3-(2,6-dimethylphenoxy)-2-hydroxypropyl]-7-nitro-3-(1-pyrrolidinyl)-2-quinoxalinone IUPAC Name: 1-[3-(2,6-dimethylphenoxy)-2-hydroxypropyl]-7-nitro-3-pyrrolidin-1-ylquinoxalin-2-one Traditional Name: 1-[3-(2,6-dimethylphenoxy)-2-hydroxy-propyl]-7-nitro-3-pyrrolidino-quinoxalin-2-one Formula: C23H26N4O5 MolecularWeight: 438.47634

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)OCC(CN2C3=C(C=CC(=C3)[N+](=O)[O-])N=C(C2=O)N4CCCC4)O

Isomeric SMILES

CC1=C(C(=CC=C1)C)OCC(CN2C3=C(C=CC(=C3)[N+](=O)[O-])N=C(C2=O)N4CCCC4)O

InChI

InChI=1S/C23H26N4O5/c1-15-6-5-7-16(2)21(15)32-14-18(28)13-26-20-12-17(27(30)31)8-9-19(20)24-22(23(26)29)25-10-3-4-11-25/h5-9,12,18,28H,3-4,10-11,13-14H2,1-2H3