2-(5-nitro-2-pyrrolidin-1-yl-phenyl)-2,3-dihydro-1,3-benzoxazin-4-one

Systemtic Name: 2-(5-nitro-2-pyrrolidin-1-yl-phenyl)-2,3-dihydro-1,3-benzoxazin-4-one Openeye Name: 2-(5-nitro-2-pyrrolidin-1-yl-phenyl)-2,3-dihydro-1,3-benzoxazin-4-one CAS Name: 2-[5-nitro-2-(1-pyrrolidinyl)phenyl]-2,3-dihydro-1,3-benzoxazin-4-one IUPAC Name: 2-(5-nitro-2-pyrrolidin-1-ylphenyl)-2,3-dihydro-1,3-benzoxazin-4-one Traditional Name: 2-(5-nitro-2-pyrrolidino-phenyl)-2,3-dihydro-1,3-benzoxazin-4-one Formula: C18H17N3O4 MolecularWeight: 339.34528

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=C(C=C2)[N+](=O)[O-])C3NC(=O)C4=CC=CC=C4O3

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C=C2)[N+](=O)[O-])C3NC(=O)C4=CC=CC=C4O3

InChI

InChI=1S/C18H17N3O4/c22-17-13-5-1-2-6-16(13)25-18(19-17)14-11-12(21(23)24)7-8-15(14)20-9-3-4-10-20/h1-2,5-8,11,18H,3-4,9-10H2,(H,19,22)